N-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]carbothioyl-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]carbothioyl-4-(2-methylpropoxy)benzamide Openeye Name: 4-isobutoxy-N-[4-(4-methoxy-2-nitro-phenyl)piperazine-1-carbothioyl]benzamide CAS Name: N-[[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[4-(4-methoxy-2-nitrophenyl)piperazine-1-carbothioyl]-4-(2-methylpropoxy)benzamide Traditional Name: 4-isobutoxy-N-[4-(4-methoxy-2-nitro-phenyl)piperazine-1-carbothioyl]benzamide Formula: C23H28N4O5S MolecularWeight: 472.55722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O5S/c1-16(2)15-32-18-6-4-17(5-7-18)22(28)24-23(33)26-12-10-25(11-13-26)20-9-8-19(31-3)14-21(20)27(29)30/h4-9,14,16H,10-13,15H2,1-3H3,(H,24,28,33)