4-[3-(4-methyl-3-nitro-phenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[3-(4-methyl-3-nitro-phenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[3-(4-methyl-3-nitro-phenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[3-(4-methyl-3-nitrophenyl)phenyl]sulfonyl-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[3-(4-methyl-3-nitrophenyl)phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[3-(4-methyl-3-nitro-phenyl)phenyl]sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C19H17N3O4S3 MolecularWeight: 447.55098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O4S3/c1-11-6-7-13(9-15(11)22(23)24)12-4-3-5-14(8-12)29(25,26)17-10-16(18(20)21)28-19(17)27-2/h3-10H,1-2H3,(H3,20,21)