ethyl 4-[[4-(5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepin-2-yl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate hydrochloride

Systemtic Name: ethyl 4-[[4-(5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepin-2-yl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate hydrochloride Openeye Name: ethyl 4-[[4-(5,6,7,8-tetrahydro-4H-thiazolo[4,5-d]azepin-2-yl)piperidine-1-carbonyl]amino]cyclohexanecarboxylate hydrochloride CAS Name: 4-[[oxo-[4-(5,6,7,8-tetrahydro-4H-thiazolo[4,5-d]azepin-2-yl)-1-piperidinyl]methyl]amino]-1-cyclohexanecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[[4-(5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepin-2-yl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-[[4-(5,6,7,8-tetrahydro-4H-thiazol[4,5-d]azepin-2-yl)piperidine-1-carbonyl]amino]cyclohexanecarboxylic acid ethyl ester hydrochloride Formula: C22H35ClN4O3S MolecularWeight: 471.0563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=NC4=C(S3)CCNCC4.Cl

Isomeric SMILES

CCOC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=NC4=C(S3)CCNCC4.Cl

InChI

InChI=1S/C22H34N4O3S.ClH/c1-2-29-21(27)16-3-5-17(6-4-16)24-22(28)26-13-9-15(10-14-26)20-25-18-7-11-23-12-8-19(18)30-20;/h15-17,23H,2-14H2,1H3,(H,24,28);1H