1-(1,3-benzodioxol-5-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]ethanone Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(N2C3=CC=CC=C3)SCC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC2=C(C1)N=C(N2C3=CC=CC=C3)SCC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H20N2O3S/c25-19(15-10-11-20-21(12-15)27-14-26-20)13-28-22-23-17-8-4-5-9-18(17)24(22)16-6-2-1-3-7-16/h1-3,6-7,10-12H,4-5,8-9,13-14H2