(4-tert-butylphenyl)-[(3S)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[(3S)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]methanone Openeye Name: (4-tert-butylphenyl)-[(3S)-1-[(2-methylthiazol-5-yl)methyl]-3-piperidyl]methanone CAS Name: (4-tert-butylphenyl)-[(3S)-1-[(2-methyl-5-thiazolyl)methyl]-3-piperidinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[(3S)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]methanone Traditional Name: (4-tert-butylphenyl)-[(3S)-1-[(2-methylthiazol-5-yl)methyl]-3-piperidyl]methanone Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(S1)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NC=C(S1)CN2CCC[C@@H](C2)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H28N2OS/c1-15-22-12-19(25-15)14-23-11-5-6-17(13-23)20(24)16-7-9-18(10-8-16)21(2,3)4/h7-10,12,17H,5-6,11,13-14H2,1-4H3/t17-/m0/s1