N-[4-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-thiophen-2-yl]cyclopropanecarboxamide

Systemtic Name: N-[4-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-thiophen-2-yl]cyclopropanecarboxamide Openeye Name: N-[4-methyl-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-thienyl]cyclopropanecarboxamide CAS Name: N-[4-methyl-5-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-2-thiophenyl]cyclopropanecarboxamide IUPAC Name: N-[4-methyl-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]thiophen-2-yl]cyclopropanecarboxamide Traditional Name: N-[4-methyl-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-thienyl]cyclopropanecarboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4S/c1-13-12-17(21-19(25)14-2-3-14)29-18(13)20(26)23-10-8-22(9-11-23)15-4-6-16(7-5-15)24(27)28/h4-7,12,14H,2-3,8-11H2,1H3,(H,21,25)