N-[4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-[4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]-5-nitro-thiophene-2-carboxamide Openeye Name: N-[4-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]-4-piperidyl]-5-nitro-thiophene-2-carboxamide CAS Name: N-[4-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]-4-piperidinyl]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-[4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]piperidin-4-yl]-5-nitrothiophene-2-carboxamide Traditional Name: N-[4-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]-4-piperidyl]-5-nitro-thiophene-2-carboxamide Formula: C23H29N5O4S MolecularWeight: 471.57246

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3(CCNCC3)NC(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3(CCNCC3)NC(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O4S/c1-16-4-3-5-18(14-16)27-13-12-26(15-17(27)2)22(30)23(8-10-24-11-9-23)25-21(29)19-6-7-20(33-19)28(31)32/h3-7,14,17,24H,8-13,15H2,1-2H3,(H,25,29)