prop-2-ynyl 4-[4-(1H-benzimidazol-2-ylmethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-(1H-benzimidazol-2-ylmethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-(1H-benzimidazol-2-ylmethylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(1H-benzimidazol-2-ylmethylamino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-(1H-benzimidazol-2-ylmethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(1H-benzimidazol-2-ylmethylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O3S/c1-2-11-29-21(28)26-9-7-14(8-10-26)20-25-17(13-30-20)19(27)22-12-18-23-15-5-3-4-6-16(15)24-18/h1,3-6,13-14H,7-12H2,(H,22,27)(H,23,24)