1-cyclohexyl-3-methyl-N-[6-(4-oxidanylpiperidin-1-yl)pyridin-3-yl]thieno[2,3-c]pyrazole-5-carboxamide hydrate

Systemtic Name: 1-cyclohexyl-3-methyl-N-[6-(4-oxidanylpiperidin-1-yl)pyridin-3-yl]thieno[2,3-c]pyrazole-5-carboxamide hydrate Openeye Name: 1-cyclohexyl-N-[6-(4-hydroxy-1-piperidyl)-3-pyridyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide hydrate CAS Name: 1-cyclohexyl-N-[6-(4-hydroxy-1-piperidinyl)-3-pyridinyl]-3-methyl-5-thieno[2,3-c]pyrazolecarboxamide hydrate IUPAC Name: 1-cyclohexyl-N-[6-(4-hydroxypiperidin-1-yl)pyridin-3-yl]-3-methylthieno[2,3-c]pyrazole-5-carboxamide hydrate Traditional Name: 1-cyclohexyl-N-[6-(4-hydroxypiperidino)-3-pyridyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide hydrate Formula: C23H31N5O3S MolecularWeight: 457.58894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3=CN=C(C=C3)N4CCC(CC4)O)C5CCCCC5.O

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3=CN=C(C=C3)N4CCC(CC4)O)C5CCCCC5.O

InChI

InChI=1S/C23H29N5O2S.H2O/c1-15-19-13-20(31-23(19)28(26-15)17-5-3-2-4-6-17)22(30)25-16-7-8-21(24-14-16)27-11-9-18(29)10-12-27;/h7-8,13-14,17-18,29H,2-6,9-12H2,1H3,(H,25,30);1H2