prop-2-ynyl 4-[4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(1-benzyl-4-piperidyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(1-benzylpiperidin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(1-benzyl-4-piperidyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O3S/c1-2-16-32-25(31)29-14-8-20(9-15-29)24-27-22(18-33-24)23(30)26-21-10-12-28(13-11-21)17-19-6-4-3-5-7-19/h1,3-7,18,20-21H,8-17H2,(H,26,30)