4-[3-(3-oxidanylidenebutyl)-5-(phenylcarbonyl)-2-sulfanylidene-benzimidazol-1-yl]butan-2-one

Systemtic Name: 4-[3-(3-oxidanylidenebutyl)-5-(phenylcarbonyl)-2-sulfanylidene-benzimidazol-1-yl]butan-2-one Openeye Name: 4-[5-benzoyl-3-(3-oxobutyl)-2-thioxo-benzimidazol-1-yl]butan-2-one CAS Name: 4-[5-benzoyl-3-(3-oxobutyl)-2-sulfanylidene-1-benzimidazolyl]-2-butanone IUPAC Name: 4-[5-benzoyl-3-(3-oxobutyl)-2-sulfanylidenebenzimidazol-1-yl]butan-2-one Traditional Name: 4-[5-benzoyl-3-(3-ketobutyl)-2-thioxo-benzimidazol-1-yl]butan-2-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)N(C1=S)CCC(=O)C

Isomeric SMILES

CC(=O)CCN1C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)N(C1=S)CCC(=O)C

InChI

InChI=1S/C22H22N2O3S/c1-15(25)10-12-23-19-9-8-18(21(27)17-6-4-3-5-7-17)14-20(19)24(22(23)28)13-11-16(2)26/h3-9,14H,10-13H2,1-2H3