N-[(2-nitrophenyl)methyl]-2-[1-(4-propan-2-yloxyphenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(2-nitrophenyl)methyl]-2-[1-(4-propan-2-yloxyphenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(4-isopropoxybenzoyl)-4-piperidyl]-N-[(2-nitrophenyl)methyl]thiazole-4-carboxamide CAS Name: N-[(2-nitrophenyl)methyl]-2-[1-[oxo-(4-propan-2-yloxyphenyl)methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-[(2-nitrophenyl)methyl]-2-[1-(4-propan-2-yloxybenzoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-(4-isopropoxybenzoyl)-4-piperidyl]-N-(2-nitrobenzyl)thiazole-4-carboxamide Formula: C26H28N4O5S MolecularWeight: 508.58932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C26H28N4O5S/c1-17(2)35-21-9-7-19(8-10-21)26(32)29-13-11-18(12-14-29)25-28-22(16-36-25)24(31)27-15-20-5-3-4-6-23(20)30(33)34/h3-10,16-18H,11-15H2,1-2H3,(H,27,31)