CAS RN: 96020-51-8
CAS Name: 1-(5,11-dihydro-[1]benzothiepino[3,4-b]pyridin-11-yl)-1,3-diethylurea
OPENEYE Name: 1-(5,11-dihydro-[1]benzothiepino[3,4-b]pyridin-11-yl)-1,3-diethyl-urea
IUPAC Name: 1-(5,11-dihydro-[1]benzothiepino[3,4-b]pyridin-11-yl)-1,3-diethylurea
SYSTEMATIC NAME: 1-(5,11-dihydro-[1]benzothiepino[3,4-b]pyridin-11-yl)-1,3-diethyl-urea
MOLECULAR FORMULA: C18H21N3OS
MOLECULAR WEIGHT: 327.44384
SMILES: CCNC(=O)N(CC)C1C2=C(CSC3=CC=CC=C13)N=CC=C2
Structure:
CAS RN: 96860-89-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H36N4O5
MOLECULAR WEIGHT: 484.58784
SMILES: CCCN1C[C@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)NC(=O)N(CC)CC.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 102492-21-7
CAS Name: 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]urea
OPENEYE Name: 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]urea
IUPAC Name: 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[(3S,4S,5R,6S)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]-1-nitroso-urea
MOLECULAR FORMULA: C9H16ClN3O7
MOLECULAR WEIGHT: 313.69224
SMILES: C(CCl)N(C(=O)N[C@H]1[C@@H]([C@H]([C@@H](OC1O)CO)O)O)N=O
Structure:
CAS RN: 97121-81-8
CAS Name: 1-[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphorinan-4-yl]-1-hydroxy-3-(9-oxo-2-fluorenyl)urea
OPENEYE Name: 1-[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphinan-4-yl]-1-hydroxy-3-(9-oxofluoren-2-yl)urea
IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphinan-4-yl]-1-hydroxy-3-(9-oxofluoren-2-yl)urea
SYSTEMATIC NAME: 1-[2-[bis(2-chloroethyl)amino]-2-oxidanylidene-1,3,2$l^{5}-oxazaphosphinan-4-yl]-1-oxidanyl-3-(9-oxidanylidenefluoren-2-yl)urea
MOLECULAR FORMULA: C21H23Cl2N4O5P
MOLECULAR WEIGHT: 513.310881
SMILES: C1COP(=O)(NC1N(C(=O)NC2=CC3=C(C=C2)C4=CC=CC=C4C3=O)O)N(CCCl)CCCl
Structure:
CAS RN: 97139-29-2
CAS Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphorinan-4-yl]-1-hydroxy-3-(4-oxo-3H-pyridin-5-yl)urea
OPENEYE Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-hydroxy-3-(4-oxo-3H-pyridin-5-yl)urea
IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-hydroxy-3-(4-oxo-3H-pyridin-5-yl)urea
SYSTEMATIC NAME: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-oxidanyl-3-(4-oxidanylidene-3H-pyridin-5-yl)urea
MOLECULAR FORMULA: C13H20Cl2N5O4P
MOLECULAR WEIGHT: 412.208761
SMILES: C1COP(NC1N(C(=O)NC2=CN=CCC2=O)O)N(CCCl)CCCl
Structure:
CAS RN: 97139-72-5
CAS Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphorinan-4-yl]-1-hydroxy-3-(4-oxo-1-cyclohexa-1,5-dienyl)urea
OPENEYE Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-hydroxy-3-(4-oxocyclohexa-1,5-dien-1-yl)urea
IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-hydroxy-3-(4-oxocyclohexa-1,5-dien-1-yl)urea
SYSTEMATIC NAME: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-oxidanyl-3-(4-oxidanylidenecyclohexa-1,5-dien-1-yl)urea
MOLECULAR FORMULA: C14H21Cl2N4O4P
MOLECULAR WEIGHT: 411.220701
SMILES: C1COP(NC1N(C(=O)NC2=CCC(=O)C=C2)O)N(CCCl)CCCl
Structure:
CAS RN: 97139-47-4
CAS Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphorinan-4-yl]-1-hydroxy-3-methyl-3-(4-oxo-1-cyclohexa-1,5-dienyl)urea
OPENEYE Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-hydroxy-3-methyl-3-(4-oxocyclohexa-1,5-dien-1-yl)urea
IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-1-hydroxy-3-methyl-3-(4-oxocyclohexa-1,5-dien-1-yl)urea
SYSTEMATIC NAME: 1-[2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-yl]-3-methyl-1-oxidanyl-3-(4-oxidanylidenecyclohexa-1,5-dien-1-yl)urea
MOLECULAR FORMULA: C15H23Cl2N4O4P
MOLECULAR WEIGHT: 425.247281
SMILES: CN(C1=CCC(=O)C=C1)C(=O)N(C2CCOP(N2)N(CCCl)CCCl)O
Structure:
CAS RN: 97139-21-4
CAS Name: 1-[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphorinan-4-yl]-3-(9H-fluoren-2-yl)-1-hydroxyurea
OPENEYE Name: 1-[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphinan-4-yl]-3-(9H-fluoren-2-yl)-1-hydroxy-urea
IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphinan-4-yl]-3-(9H-fluoren-2-yl)-1-hydroxyurea
SYSTEMATIC NAME: 1-[2-[bis(2-chloroethyl)amino]-2-oxidanylidene-1,3,2$l^{5}-oxazaphosphinan-4-yl]-3-(9H-fluoren-2-yl)-1-oxidanyl-urea
MOLECULAR FORMULA: C21H25Cl2N4O4P
MOLECULAR WEIGHT: 499.327361
SMILES: C1COP(=O)(NC1N(C(=O)NC2=CC3=C(C=C2)C4=CC=CC=C4C3)O)N(CCCl)CCCl
Structure:
CAS RN: 102613-13-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H38Cl2N2
MOLECULAR WEIGHT: 413.46722
SMILES: C=CCCCCCCCCCNC1=CC2=C3C(=C1)CCCN3CCC2.Cl.Cl
Structure:
CAS RN: 102613-12-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H34N2O
MOLECULAR WEIGHT: 354.52886
SMILES: C=CC(CCCCCCCC(=O)N)C1=CC2=C3C(=C1)CCCN3CCC2
Structure:
CAS RN: 102613-05-8
CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-10-undecenamide
OPENEYE Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]undec-10-enamide
IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]undec-10-enamide
SYSTEMATIC NAME: N-[2-(1,3-benzodioxol-5-yl)ethyl]undec-10-enamide
MOLECULAR FORMULA: C20H29NO3
MOLECULAR WEIGHT: 331.44916
SMILES: C=CCCCCCCCCC(=O)NCCC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 102612-98-6
CAS Name: 10-bromo-N-[(4-hydroxy-3-methoxyphenyl)methyl]undecanamide
OPENEYE Name: 10-bromo-N-[(4-hydroxy-3-methoxy-phenyl)methyl]undecanamide
IUPAC Name: 10-bromo-N-[(4-hydroxy-3-methoxyphenyl)methyl]undecanamide
SYSTEMATIC NAME: 10-bromanyl-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]undecanamide
MOLECULAR FORMULA: C19H30BrNO3
MOLECULAR WEIGHT: 400.3504
SMILES: CC(CCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC)Br
Structure:
CAS RN: 11075-36-8
CAS Name: 3,6-diamino-N-[(6Z)-3-[(4S,6R)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-6-[(carbamoylamino)methylidene]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxyhexanamide
OPENEYE Name: 3,6-diamino-N-[(6Z)-3-[(4S,6R)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-6-(ureidomethylene)-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxy-hexanamide
IUPAC Name: 3,6-diamino-N-[(6Z)-3-[(4S,6R)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-6-[(carbamoylamino)methylidene]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxyhexanamide
SYSTEMATIC NAME: N-[(6Z)-6-[(aminocarbonylamino)methylidene]-3-[(4S,6R)-2-azanyl-4-oxidanyl-1,4,5,6-tetrahydropyrimidin-6-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentakis(oxidanylidene)-1,4,7,10,13-pentazacyclohexadec-15-yl]-3,6-bis(azanyl)-4-oxidanyl-hexanamide
MOLECULAR FORMULA: C25H43N13O11
MOLECULAR WEIGHT: 701.68942
SMILES: C1[C@@H](NC(=N[C@H]1O)N)C2C(=O)NCC(C(=O)NC(C(=O)NC(C(=O)N/C(=C\NC(=O)N)/C(=O)N2)CO)CO)NC(=O)CC(C(CCN)O)N
Structure:
CAS RN: 11075-68-6
CAS Name: 3,6-diamino-N-[(6Z)-3-[(4S,6R)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-6-[(carbamoylamino)methylidene]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxyhexanamide
OPENEYE Name: 3,6-diamino-N-[(6Z)-3-[(4S,6R)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-6-(ureidomethylene)-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxy-hexanamide
IUPAC Name: 3,6-diamino-N-[(6Z)-3-[(4S,6R)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-6-[(carbamoylamino)methylidene]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxyhexanamide
SYSTEMATIC NAME: N-[(6Z)-6-[(aminocarbonylamino)methylidene]-3-[(4S,6R)-2-azanyl-4-oxidanyl-1,4,5,6-tetrahydropyrimidin-6-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentakis(oxidanylidene)-1,4,7,10,13-pentazacyclohexadec-15-yl]-3,6-bis(azanyl)-4-oxidanyl-hexanamide
MOLECULAR FORMULA: C25H43N13O11
MOLECULAR WEIGHT: 701.68942
SMILES: C1[C@@H](NC(=N[C@H]1O)N)C2C(=O)NCC(C(=O)NC(C(=O)NC(C(=O)N/C(=C\NC(=O)N)/C(=O)N2)CO)CO)NC(=O)CC(C(CCN)O)N
Structure:
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