CAS RN: 1480-95-1
CAS Name: 5-fluoro-6-(methylthio)-1H-pyrimidin-2-one
OPENEYE Name: 5-fluoro-6-methylsulfanyl-1H-pyrimidin-2-one
IUPAC Name: 5-fluoro-6-methylsulfanyl-1H-pyrimidin-2-one
SYSTEMATIC NAME: 5-fluoranyl-6-methylsulfanyl-1H-pyrimidin-2-one
MOLECULAR FORMULA: C5H5FN2OS
MOLECULAR WEIGHT: 160.169403
SMILES: CSC1=C(C=NC(=O)N1)F
Structure:
CAS RN: 4443-39-4
CAS Name: 2-(1,3-dioxo-2-isoindolyl)butanedioic acid
OPENEYE Name: 2-(1,3-dioxoisoindolin-2-yl)butanedioic acid
IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)butanedioic acid
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]butanedioic acid
MOLECULAR FORMULA: C12H9NO6
MOLECULAR WEIGHT: 263.20296
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)C(CC(=O)O)C(=O)O
Structure:
CAS RN: 93692-63-8
CAS Name: thiocyanic acid [2-bromo-4-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2-bromo-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2-bromo-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2-bromanyl-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C10H7BrN2S2
MOLECULAR WEIGHT: 299.20998
SMILES: C1=CC(=C(C=C1CSC#N)Br)CSC#N
Structure:
CAS RN: 93168-15-1
CAS Name: thiocyanic acid [2,3,5-trichloro-4-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2,3,5-trichloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2,3,5-trichloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2,3,5-tris(chloranyl)-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C10H5Cl3N2S2
MOLECULAR WEIGHT: 323.6491
SMILES: C1=C(C(=C(C(=C1Cl)CSC#N)Cl)Cl)CSC#N
Structure:
CAS RN: 93262-83-0
CAS Name: thiocyanic acid [2-chloro-5-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2-chloro-5-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2-chloro-5-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2-chloranyl-5-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C10H7ClN2S2
MOLECULAR WEIGHT: 254.75898
SMILES: C1=CC(=C(C=C1CSC#N)CSC#N)Cl
Structure:
CAS RN: 13002-77-2
CAS Name: thiocyanic acid [2,5-dichloro-4-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2,5-dichloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2,5-dichloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2,5-bis(chloranyl)-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C10H6Cl2N2S2
MOLECULAR WEIGHT: 289.20404
SMILES: C1=C(C(=CC(=C1Cl)CSC#N)Cl)CSC#N
Structure:
CAS RN: 85071-30-3
CAS Name: thiocyanic acid [2,3,5,6-tetrachloro-4-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2,3,5,6-tetrachloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2,3,5,6-tetrachloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2,3,5,6-tetrakis(chloranyl)-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C10H4Cl4N2S2
MOLECULAR WEIGHT: 358.09416
SMILES: C(C1=C(C(=C(C(=C1Cl)Cl)CSC#N)Cl)Cl)SC#N
Structure:
CAS RN: 70477-55-3
CAS Name: thiocyanic acid [2,3,5,6-tetramethyl-4-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2,3,5,6-tetramethyl-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2,3,5,6-tetramethyl-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2,3,5,6-tetramethyl-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C14H16N2S2
MOLECULAR WEIGHT: 276.42024
SMILES: CC1=C(C(=C(C(=C1CSC#N)C)C)CSC#N)C
Structure:
CAS RN: 2425-03-8
CAS Name: thiocyanic acid [2-chloro-4-(thiocyanatomethyl)phenyl]methyl ester
OPENEYE Name: [2-chloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
IUPAC Name: [2-chloro-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
SYSTEMATIC NAME: [2-chloranyl-4-(thiocyanatomethyl)phenyl]methyl thiocyanate
MOLECULAR FORMULA: C10H7ClN2S2
MOLECULAR WEIGHT: 254.75898
SMILES: C1=CC(=C(C=C1CSC#N)Cl)CSC#N
Structure:
CAS RN: 58228-67-4
CAS Name: N-(4-amino-1,3,5-triazin-2-yl)acetamide
OPENEYE Name: N-(4-amino-1,3,5-triazin-2-yl)acetamide
IUPAC Name: N-(4-amino-1,3,5-triazin-2-yl)acetamide
SYSTEMATIC NAME: N-(4-azanyl-1,3,5-triazin-2-yl)ethanamide
MOLECULAR FORMULA: C5H7N5O
MOLECULAR WEIGHT: 153.14198
SMILES: CC(=O)NC1=NC=NC(=N1)N
Structure:
CAS RN: 19438-85-8
CAS Name: 6-[2-(4,6-diamino-1,3,5-triazin-2-yl)cyclobutyl]-1,3,5-triazine-2,4-diamine
OPENEYE Name: 6-[2-(4,6-diamino-1,3,5-triazin-2-yl)cyclobutyl]-1,3,5-triazine-2,4-diamine
IUPAC Name: 6-[2-(4,6-diamino-1,3,5-triazin-2-yl)cyclobutyl]-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-[2-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]cyclobutyl]-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C10H14N10
MOLECULAR WEIGHT: 274.28516
SMILES: C1CC(C1C2=NC(=NC(=N2)N)N)C3=NC(=NC(=N3)N)N
Structure:
CAS RN: 1122-09-4
CAS Name: 3-azabicyclo[3.2.0]heptane-2,4-dione
OPENEYE Name: 3-azabicyclo[3.2.0]heptane-2,4-dione
IUPAC Name: 3-azabicyclo[3.2.0]heptane-2,4-dione
SYSTEMATIC NAME: 3-azabicyclo[3.2.0]heptane-2,4-dione
MOLECULAR FORMULA: C6H7NO2
MOLECULAR WEIGHT: 125.12528
SMILES: C1CC2C1C(=O)NC2=O
Structure:
CAS RN: 7663-76-5
CAS Name: 3-(2-oxo-1-pyrrolidinyl)propanenitrile
OPENEYE Name: 3-(2-oxopyrrolidin-1-yl)propanenitrile
IUPAC Name: 3-(2-oxopyrrolidin-1-yl)propanenitrile
SYSTEMATIC NAME: 3-(2-oxidanylidenepyrrolidin-1-yl)propanenitrile
MOLECULAR FORMULA: C7H10N2O
MOLECULAR WEIGHT: 138.1671
SMILES: C1CC(=O)N(C1)CCC#N
Structure:
CAS RN: 15100-45-5
CAS Name: 4-imino-3-azabicyclo[3.2.0]hept-2-en-2-amine
OPENEYE Name: 4-imino-3-azabicyclo[3.2.0]hept-2-en-2-amine
IUPAC Name: 4-imino-3-azabicyclo[3.2.0]hept-2-en-2-amine
SYSTEMATIC NAME: 4-azanylidene-3-azabicyclo[3.2.0]hept-2-en-2-amine
MOLECULAR FORMULA: C6H9N3
MOLECULAR WEIGHT: 123.15576
SMILES: C1CC2C1C(=NC2=N)N
Structure:
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