N-(4-nitrophenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propanamide

Systemtic Name: N-(4-nitrophenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propanamide Openeye Name: N-(4-nitrophenyl)-2-[4-(2-thienylmethyl)piperazin-1-yl]propanamide CAS Name: N-(4-nitrophenyl)-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]propanamide IUPAC Name: N-(4-nitrophenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propanamide Traditional Name: N-(4-nitrophenyl)-2-[4-(2-thenyl)piperazino]propionamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C18H22N4O3S/c1-14(18(23)19-15-4-6-16(7-5-15)22(24)25)21-10-8-20(9-11-21)13-17-3-2-12-26-17/h2-7,12,14H,8-11,13H2,1H3,(H,19,23)