N-(2-methoxy-4-nitro-phenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(2-methoxy-4-nitrophenyl)-4-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C19H22N4O4S MolecularWeight: 402.46738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N4O4S/c1-26-16-5-3-4-14(12-16)21-8-10-22(11-9-21)19(28)20-17-7-6-15(23(24)25)13-18(17)27-2/h3-7,12-13H,8-11H2,1-2H3,(H,20,28)