CAS RN: 54522-09-7
CAS Name: 2-(6-amino-5-bromo-2,4-dioxo-1-pyrimidinyl)acetic acid
OPENEYE Name: 2-(6-amino-5-bromo-2,4-dioxo-pyrimidin-1-yl)acetic acid
IUPAC Name: 2-(6-amino-5-bromo-2,4-dioxopyrimidin-1-yl)acetic acid
SYSTEMATIC NAME: 2-[6-azanyl-5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoic acid
MOLECULAR FORMULA: C6H6BrN3O4
MOLECULAR WEIGHT: 264.03354
SMILES: C(C(=O)O)N1C(=C(C(=O)NC1=O)Br)N
Structure:
CAS RN: 15316-91-3
CAS Name: 2-methyl-N-prop-2-enylaniline
OPENEYE Name: N-allyl-2-methyl-aniline
IUPAC Name: 2-methyl-N-prop-2-enylaniline
SYSTEMATIC NAME: 2-methyl-N-prop-2-enyl-aniline
MOLECULAR FORMULA: C10H13N
MOLECULAR WEIGHT: 147.21692
SMILES: CC1=CC=CC=C1NCC=C
Structure:
CAS RN: 94092-91-8
CAS Name: 1-but-3-enylpyrrolidine
OPENEYE Name: 1-but-3-enylpyrrolidine
IUPAC Name: 1-but-3-enylpyrrolidine
SYSTEMATIC NAME: 1-but-3-enylpyrrolidine
MOLECULAR FORMULA: C8H15N
MOLECULAR WEIGHT: 125.2114
SMILES: C=CCCN1CCCC1
Structure:
CAS RN: 2927-71-1
CAS Name: 2,4-dichloro-5-fluoropyrimidine
OPENEYE Name: 2,4-dichloro-5-fluoro-pyrimidine
IUPAC Name: 2,4-dichloro-5-fluoropyrimidine
SYSTEMATIC NAME: 2,4-bis(chloranyl)-5-fluoranyl-pyrimidine
MOLECULAR FORMULA: C4HCl2FN2
MOLECULAR WEIGHT: 166.968543
SMILES: C1=C(C(=NC(=N1)Cl)Cl)F
Structure:
CAS RN: 4294-16-0
CAS Name: 2-(hydroxymethyl)-5-[6-[(phenylmethyl)amino]-9-purinyl]oxolane-3,4-diol
OPENEYE Name: 2-[6-(benzylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-[6-(benzylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-[6-[(phenylmethyl)amino]purin-9-yl]oxolane-3,4-diol
MOLECULAR FORMULA: C17H19N5O4
MOLECULAR WEIGHT: 357.36386
SMILES: C1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O
Structure:
CAS RN: 90645-84-4
CAS Name: 1,7-bis(phenylmethyl)-6-purinethione
OPENEYE Name: 1,7-dibenzylpurine-6-thione
IUPAC Name: 1,7-dibenzylpurine-6-thione
SYSTEMATIC NAME: 1,7-bis(phenylmethyl)purine-6-thione
MOLECULAR FORMULA: C19H16N4S
MOLECULAR WEIGHT: 332.42214
SMILES: C1=CC=C(C=C1)CN2C=NC3=C2C(=S)N(C=N3)CC4=CC=CC=C4
Structure:
CAS RN: 5431-51-6
CAS Name: 1,9-bis(phenylmethyl)-6-purinone
OPENEYE Name: 1,9-dibenzylpurin-6-one
IUPAC Name: 1,9-dibenzylpurin-6-one
SYSTEMATIC NAME: 1,9-bis(phenylmethyl)purin-6-one
MOLECULAR FORMULA: C19H16N4O
MOLECULAR WEIGHT: 316.35654
SMILES: C1=CC=C(C=C1)CN2C=NC3=C2N=CN(C3=O)CC4=CC=CC=C4
Structure:
CAS RN: 922-17-8
CAS Name: 2-[(3-nitrophenyl)methyl]propanedioic acid
OPENEYE Name: 2-[(3-nitrophenyl)methyl]propanedioic acid
IUPAC Name: 2-[(3-nitrophenyl)methyl]propanedioic acid
SYSTEMATIC NAME: 2-[(3-nitrophenyl)methyl]propanedioic acid
MOLECULAR FORMULA: C10H9NO6
MOLECULAR WEIGHT: 239.18156
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CC(C(=O)O)C(=O)O
Structure:
CAS RN: 56728-11-1
CAS Name: 1,4-diethyl-2-phenylpiperazine
OPENEYE Name: 1,4-diethyl-2-phenyl-piperazine
IUPAC Name: 1,4-diethyl-2-phenylpiperazine
SYSTEMATIC NAME: 1,4-diethyl-2-phenyl-piperazine
MOLECULAR FORMULA: C14H22N2
MOLECULAR WEIGHT: 218.33788
SMILES: CCN1CCN(C(C1)C2=CC=CC=C2)CC
Structure:
CAS RN: 5368-28-5
CAS Name: 3-phenyl-2-piperazinone
OPENEYE Name: 3-phenylpiperazin-2-one
IUPAC Name: 3-phenylpiperazin-2-one
SYSTEMATIC NAME: 3-phenylpiperazin-2-one
MOLECULAR FORMULA: C10H12N2O
MOLECULAR WEIGHT: 176.21508
SMILES: C1CNC(=O)C(N1)C2=CC=CC=C2
Structure:
CAS RN: 5368-20-7
CAS Name: 4-methyl-3-phenyl-2-piperazinone
OPENEYE Name: 4-methyl-3-phenyl-piperazin-2-one
IUPAC Name: 4-methyl-3-phenylpiperazin-2-one
SYSTEMATIC NAME: 4-methyl-3-phenyl-piperazin-2-one
MOLECULAR FORMULA: C11H14N2O
MOLECULAR WEIGHT: 190.24166
SMILES: CN1CCNC(=O)C1C2=CC=CC=C2
Structure:
CAS RN: 5271-26-1
CAS Name: 2-phenylpiperazine
OPENEYE Name: 2-phenylpiperazine
IUPAC Name: 2-phenylpiperazine
SYSTEMATIC NAME: 2-phenylpiperazine
MOLECULAR FORMULA: C10H14N2
MOLECULAR WEIGHT: 162.23156
SMILES: C1CNC(CN1)C2=CC=CC=C2
Structure:
CAS RN: 91090-24-3
CAS Name: N-[6-chloro-9-(2-oxolanyl)-2-purinyl]acetamide
OPENEYE Name: N-(6-chloro-9-tetrahydrofuran-2-yl-purin-2-yl)acetamide
IUPAC Name: N-[6-chloro-9-(oxolan-2-yl)purin-2-yl]acetamide
SYSTEMATIC NAME: N-[6-chloranyl-9-(oxolan-2-yl)purin-2-yl]ethanamide
MOLECULAR FORMULA: C11H12ClN5O2
MOLECULAR WEIGHT: 281.69828
SMILES: CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C3CCCO3
Structure:
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