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

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide CAS Name: N-(2-methoxy-4-nitrophenyl)-3-methyl-4-(4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H24N4O3S/c1-14-4-6-16(7-5-14)23-11-10-22(13-15(23)2)20(28)21-18-9-8-17(24(25)26)12-19(18)27-3/h4-9,12,15H,10-11,13H2,1-3H3,(H,21,28)