N-(3-cyanothiophen-2-yl)-3-[4-(4-nitrophenyl)piperazin-1-yl]propanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-[4-(4-nitrophenyl)piperazin-1-yl]propanamide Openeye Name: N-(3-cyano-2-thienyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]propanamide CAS Name: N-(3-cyano-2-thiophenyl)-3-[4-(4-nitrophenyl)-1-piperazinyl]propanamide IUPAC Name: N-(3-cyanothiophen-2-yl)-3-[4-(4-nitrophenyl)piperazin-1-yl]propanamide Traditional Name: N-(3-cyano-2-thienyl)-3-[4-(4-nitrophenyl)piperazino]propionamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O3S/c19-13-14-6-12-27-18(14)20-17(24)5-7-21-8-10-22(11-9-21)15-1-3-16(4-2-15)23(25)26/h1-4,6,12H,5,7-11H2,(H,20,24)