6-[(E)-2-methylsulfanyl-1-phenyl-ethenyl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine

Systemtic Name: 6-[(E)-2-methylsulfanyl-1-phenyl-ethenyl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine Openeye Name: 1-isopropylsulfonyl-6-[(E)-2-methylsulfanyl-1-phenyl-vinyl]benzimidazol-2-amine CAS Name: 6-[(E)-2-(methylthio)-1-phenylethenyl]-1-propan-2-ylsulfonyl-2-benzimidazolamine IUPAC Name: 6-[(E)-2-methylsulfanyl-1-phenylethenyl]-1-propan-2-ylsulfonylbenzimidazol-2-amine Traditional Name: [1-isopropylsulfonyl-6-[(E)-2-(methylthio)-1-phenyl-vinyl]benzimidazol-2-yl]amine Formula: C19H21N3O2S2 MolecularWeight: 387.51894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(=CSC)C3=CC=CC=C3)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)/C(=C/SC)/C3=CC=CC=C3)N=C1N

InChI

InChI=1S/C19H21N3O2S2/c1-13(2)26(23,24)22-18-11-15(9-10-17(18)21-19(22)20)16(12-25-3)14-7-5-4-6-8-14/h4-13H,1-3H3,(H2,20,21)/b16-12+