N-[(4-butylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-[(4-butylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-[(4-butylphenyl)thiocarbamoyl]-3-(3-nitrophenyl)acrylamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O3S/c1-2-3-5-15-8-11-17(12-9-15)21-20(27)22-19(24)13-10-16-6-4-7-18(14-16)23(25)26/h4,6-14H,2-3,5H2,1H3,(H2,21,22,24,27)