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

Systemtic Name: 2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-N-naphthalen-2-yl-propanamide Openeye Name: 2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(2-naphthyl)propanamide CAS Name: 2-[[3-[[(4-acetylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(2-naphthalenyl)propanamide IUPAC Name: 2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-N-naphthalen-2-ylpropanamide Traditional Name: 2-[[3-[(4-acetylphenyl)thiocarbamoylamino]phenyl]thio]-N-(2-naphthyl)propionamide Formula: C28H25N3O2S2 MolecularWeight: 499.647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=CC=CC(=C3)NC(=S)NC4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=CC=CC(=C3)NC(=S)NC4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C28H25N3O2S2/c1-18(32)20-10-13-23(14-11-20)30-28(34)31-24-8-5-9-26(17-24)35-19(2)27(33)29-25-15-12-21-6-3-4-7-22(21)16-25/h3-17,19H,1-2H3,(H,29,33)(H2,30,31,34)