N-[1-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-phenyl]carbonylpiperidin-4-yl]cyclopropanecarboxamide

Systemtic Name: N-[1-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-phenyl]carbonylpiperidin-4-yl]cyclopropanecarboxamide Openeye Name: N-[1-[4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzoyl]-4-piperidyl]cyclopropanecarboxamide CAS Name: N-[1-[[4-[(4-methyl-2-thiazolyl)thio]-3-nitrophenyl]-oxomethyl]-4-piperidinyl]cyclopropanecarboxamide IUPAC Name: N-[1-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzoyl]piperidin-4-yl]cyclopropanecarboxamide Traditional Name: N-[1-[4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzoyl]-4-piperidyl]cyclopropanecarboxamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)N3CCC(CC3)NC(=O)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)N3CCC(CC3)NC(=O)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4S2/c1-12-11-29-20(21-12)30-17-5-4-14(10-16(17)24(27)28)19(26)23-8-6-15(7-9-23)22-18(25)13-2-3-13/h4-5,10-11,13,15H,2-3,6-9H2,1H3,(H,22,25)