(E)-N-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]carbothioyl-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]carbothioyl-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[4-(4-methoxy-2-nitro-phenyl)piperazine-1-carbothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-(4-methoxy-2-nitrophenyl)piperazine-1-carbothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-(4-methoxy-2-nitro-phenyl)piperazine-1-carbothioyl]-3-(4-methoxyphenyl)acrylamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5S/c1-30-17-6-3-16(4-7-17)5-10-21(27)23-22(32)25-13-11-24(12-14-25)19-9-8-18(31-2)15-20(19)26(28)29/h3-10,15H,11-14H2,1-2H3,(H,23,27,32)/b10-5+