4-[4-azanyl-3-(2-methylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[4-azanyl-3-(2-methylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[4-amino-3-(o-tolyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[4-amino-3-(2-methylphenyl)phenyl]sulfonyl-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[4-amino-3-(2-methylphenyl)phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[4-amino-3-(o-tolyl)phenyl]sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C19H19N3O2S3 MolecularWeight: 417.56806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)N

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)N

InChI

InChI=1S/C19H19N3O2S3/c1-11-5-3-4-6-13(11)14-9-12(7-8-15(14)20)27(23,24)17-10-16(18(21)22)26-19(17)25-2/h3-10H,20H2,1-2H3,(H3,21,22)