1,8-dimethyl-N-[4-(piperidin-1-ylmethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

Systemtic Name: 1,8-dimethyl-N-[4-(piperidin-1-ylmethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Openeye Name: 1,8-dimethyl-N-[4-(1-piperidylmethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide CAS Name: 1,8-dimethyl-N-[4-(1-piperidinylmethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide IUPAC Name: 1,8-dimethyl-N-[4-(piperidin-1-ylmethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Traditional Name: 1,8-dimethyl-N-[4-(piperidinomethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)NC4=CC=C(C=C4)CN5CCCCC5)C

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)NC4=CC=C(C=C4)CN5CCCCC5)C

InChI

InChI=1S/C25H28N4OS/c1-17-6-11-22-20(14-17)24-21(16-31-22)23(27-28(24)2)25(30)26-19-9-7-18(8-10-19)15-29-12-4-3-5-13-29/h6-11,14H,3-5,12-13,15-16H2,1-2H3,(H,26,30)