4-[[4-(6-methyl-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[4-(6-methyl-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[4-(6-methyl-4,5,7,8-tetrahydrothiazolo[4,5-d]azepin-2-yl)piperidine-1-carbonyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[[4-(6-methyl-4,5,7,8-tetrahydrothiazolo[4,5-d]azepin-2-yl)-1-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[4-(6-methyl-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[4-(6-methyl-4,5,7,8-tetrahydrothiazol[4,5-d]azepin-2-yl)piperidine-1-carbonyl]amino]cyclohexanecarboxylic acid Formula: C21H32N4O3S MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(CC1)SC(=N2)C3CCN(CC3)C(=O)NC4CCC(CC4)C(=O)O

Isomeric SMILES

CN1CCC2=C(CC1)SC(=N2)C3CCN(CC3)C(=O)NC4CCC(CC4)C(=O)O

InChI

InChI=1S/C21H32N4O3S/c1-24-10-8-17-18(9-11-24)29-19(23-17)14-6-12-25(13-7-14)21(28)22-16-4-2-15(3-5-16)20(26)27/h14-16H,2-13H2,1H3,(H,22,28)(H,26,27)