prop-2-enyl 2-[1-[(4-methoxycarbonylcyclohexyl)carbamoyl]piperidin-4-yl]-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepine-6-carboxylate

Systemtic Name: prop-2-enyl 2-[1-[(4-methoxycarbonylcyclohexyl)carbamoyl]piperidin-4-yl]-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepine-6-carboxylate Openeye Name: allyl 2-[1-[(4-methoxycarbonylcyclohexyl)carbamoyl]-4-piperidyl]-4,5,7,8-tetrahydrothiazolo[4,5-d]azepine-6-carboxylate CAS Name: 2-[1-[[(4-methoxycarbonylcyclohexyl)amino]-oxomethyl]-4-piperidinyl]-4,5,7,8-tetrahydrothiazolo[4,5-d]azepine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[1-[(4-methoxycarbonylcyclohexyl)carbamoyl]piperidin-4-yl]-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepine-6-carboxylate Traditional Name: 2-[1-[(4-carbomethoxycyclohexyl)carbamoyl]-4-piperidyl]-4,5,7,8-tetrahydrothiazol[4,5-d]azepine-6-carboxylic acid allyl ester Formula: C25H36N4O5S MolecularWeight: 504.64214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=NC4=C(S3)CCN(CC4)C(=O)OCC=C

Isomeric SMILES

COC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=NC4=C(S3)CCN(CC4)C(=O)OCC=C

InChI

InChI=1S/C25H36N4O5S/c1-3-16-34-25(32)29-14-10-20-21(11-15-29)35-22(27-20)17-8-12-28(13-9-17)24(31)26-19-6-4-18(5-7-19)23(30)33-2/h3,17-19H,1,4-16H2,2H3,(H,26,31)