N-(4-acetamidophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-butanamide Openeye Name: N-(4-acetamidophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-butanamide CAS Name: N-(4-acetamidophenyl)-2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]butanamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylbutanamide Traditional Name: N-(4-acetamidophenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]butyramide Formula: C25H26N4O2S2 MolecularWeight: 478.62954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C25H26N4O2S2/c1-3-23(24(31)27-20-14-12-19(13-15-20)26-17(2)30)33-22-11-7-10-21(16-22)29-25(32)28-18-8-5-4-6-9-18/h4-16,23H,3H2,1-2H3,(H,26,30)(H,27,31)(H2,28,29,32)