N-(4-acetamidophenyl)-2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-2-[[3-[[(4-acetylanilino)-sulfanylidenemethyl]amino]phenyl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[[3-[(4-acetylphenyl)thiocarbamoylamino]phenyl]thio]propionamide Formula: C26H26N4O3S2 MolecularWeight: 506.63964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O3S2/c1-16(31)19-7-9-22(10-8-19)29-26(34)30-23-5-4-6-24(15-23)35-17(2)25(33)28-21-13-11-20(12-14-21)27-18(3)32/h4-15,17H,1-3H3,(H,27,32)(H,28,33)(H2,29,30,34)