N-[[(2S)-1-[(2-cyclopropyl-5-phenyl-1,3-thiazol-4-yl)carbonyl]piperidin-2-yl]methyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[[(2S)-1-[(2-cyclopropyl-5-phenyl-1,3-thiazol-4-yl)carbonyl]piperidin-2-yl]methyl]-3,4-dimethyl-benzamide Openeye Name: N-[[(2S)-1-(2-cyclopropyl-5-phenyl-thiazole-4-carbonyl)-2-piperidyl]methyl]-3,4-dimethyl-benzamide CAS Name: N-[[(2S)-1-[(2-cyclopropyl-5-phenyl-4-thiazolyl)-oxomethyl]-2-piperidinyl]methyl]-3,4-dimethylbenzamide IUPAC Name: N-[[(2S)-1-(2-cyclopropyl-5-phenyl-1,3-thiazole-4-carbonyl)piperidin-2-yl]methyl]-3,4-dimethylbenzamide Traditional Name: N-[[(2S)-1-(2-cyclopropyl-5-phenyl-thiazole-4-carbonyl)-2-piperidyl]methyl]-3,4-dimethyl-benzamide Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2CCCCN2C(=O)C3=C(SC(=N3)C4CC4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC[C@@H]2CCCCN2C(=O)C3=C(SC(=N3)C4CC4)C5=CC=CC=C5)C

InChI

InChI=1S/C28H31N3O2S/c1-18-11-12-22(16-19(18)2)26(32)29-17-23-10-6-7-15-31(23)28(33)24-25(20-8-4-3-5-9-20)34-27(30-24)21-13-14-21/h3-5,8-9,11-12,16,21,23H,6-7,10,13-15,17H2,1-2H3,(H,29,32)/t23-/m0/s1