methyl 4-[[3-methyl-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)phenyl]carbonylamino]cyclohexane-1-carboxylate dihydrochloride

Systemtic Name: methyl 4-[[3-methyl-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)phenyl]carbonylamino]cyclohexane-1-carboxylate dihydrochloride Openeye Name: methyl 4-[[3-methyl-4-(4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-yl)benzoyl]amino]cyclohexanecarboxylate dihydrochloride CAS Name: 4-[[[3-methyl-4-(4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-yl)phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester dihydrochloride IUPAC Name: methyl 4-[[3-methyl-4-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzoyl]amino]cyclohexane-1-carboxylate dihydrochloride Traditional Name: 4-[[3-methyl-4-(4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-yl)benzoyl]amino]cyclohexanecarboxylic acid methyl ester dihydrochloride Formula: C22H29Cl2N3O3S MolecularWeight: 486.45496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)C(=O)OC)C3=NC4=C(S3)CNCC4.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)C(=O)OC)C3=NC4=C(S3)CNCC4.Cl.Cl

InChI

InChI=1S/C22H27N3O3S.2ClH/c1-13-11-15(20(26)24-16-6-3-14(4-7-16)22(27)28-2)5-8-17(13)21-25-18-9-10-23-12-19(18)29-21;;/h5,8,11,14,16,23H,3-4,6-7,9-10,12H2,1-2H3,(H,24,26);2*1H