(E)-N-(4-methylpiperazin-1-yl)carbothioyl-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-methylpiperazin-1-yl)carbothioyl-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(4-methylpiperazine-1-carbothioyl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(4-methyl-1-piperazinyl)-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(4-methylpiperazine-1-carbothioyl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-methylpiperazine-1-carbothioyl)-3-(3-nitrophenyl)acrylamide Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=S)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O3S/c1-17-7-9-18(10-8-17)15(23)16-14(20)6-5-12-3-2-4-13(11-12)19(21)22/h2-6,11H,7-10H2,1H3,(H,16,20,23)/b6-5+