N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-nitro-4-piperidino-benzamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c1-30-17-8-5-15(6-9-17)18-14-31-22(23-18)24-21(27)16-7-10-19(20(13-16)26(28)29)25-11-3-2-4-12-25/h5-10,13-14H,2-4,11-12H2,1H3,(H,23,24,27)