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

Systemtic Name: N-(4-ethanoylphenyl)-2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide Openeye Name: N-(4-acetylphenyl)-2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide CAS Name: 2-[[3-[[(4-acetylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(4-acetylphenyl)propanamide IUPAC Name: N-(4-acetylphenyl)-2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanylpropanamide Traditional Name: N-(4-acetylphenyl)-2-[[3-[(4-acetylphenyl)thiocarbamoylamino]phenyl]thio]propionamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H25N3O3S2/c1-16(30)19-7-11-21(12-8-19)27-25(32)18(3)34-24-6-4-5-23(15-24)29-26(33)28-22-13-9-20(10-14-22)17(2)31/h4-15,18H,1-3H3,(H,27,32)(H2,28,29,33)