N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-2-[(4-nitrophenyl)thio]acetamide Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H26N4O3S/c1-3-23-10-12-24(13-11-23)18-6-9-20(16(2)14-18)22-21(26)15-29-19-7-4-17(5-8-19)25(27)28/h4-9,14H,3,10-13,15H2,1-2H3,(H,22,26)