N-[(2-nitrophenyl)carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[(2-nitrophenyl)carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[(2-nitrophenyl)carbamothioyl]-3-phenyl-propanamide CAS Name: N-[(2-nitroanilino)-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[(2-nitrophenyl)carbamothioyl]-3-phenylpropanamide Traditional Name: N-[(2-nitrophenyl)thiocarbamoyl]-3-phenyl-propionamide Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O3S/c20-15(11-10-12-6-2-1-3-7-12)18-16(23)17-13-8-4-5-9-14(13)19(21)22/h1-9H,10-11H2,(H2,17,18,20,23)