N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-4-propoxy-benzamide

Systemtic Name: N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-4-propoxy-benzamide Openeye Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]-4-propoxy-benzamide CAS Name: N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]-4-propoxybenzamide Traditional Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]-4-propoxy-benzamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4S/c1-2-15-29-19-9-3-16(4-10-19)20(26)22-21(30)24-13-11-23(12-14-24)17-5-7-18(8-6-17)25(27)28/h3-10H,2,11-15H2,1H3,(H,22,26,30)