2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-nitrophenyl)butanamide

Systemtic Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-nitrophenyl)butanamide Openeye Name: N-(4-nitrophenyl)-2-[3-(p-tolylcarbamothioylamino)phenyl]sulfanyl-butanamide CAS Name: 2-[[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(4-nitrophenyl)butanamide IUPAC Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-nitrophenyl)butanamide Traditional Name: N-(4-nitrophenyl)-2-[[3-(p-tolylthiocarbamoylamino)phenyl]thio]butyramide Formula: C24H24N4O3S2 MolecularWeight: 480.60236

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=CC(=C2)NC(=S)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=CC(=C2)NC(=S)NC3=CC=C(C=C3)C

InChI

InChI=1S/C24H24N4O3S2/c1-3-22(23(29)25-17-11-13-20(14-12-17)28(30)31)33-21-6-4-5-19(15-21)27-24(32)26-18-9-7-16(2)8-10-18/h4-15,22H,3H2,1-2H3,(H,25,29)(H2,26,27,32)