1-methyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

Systemtic Name: 1-methyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide CAS Name: 1-methyl-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Formula: C26H31N5OS MolecularWeight: 461.62224

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CSC3=CC=CC=C32)C(=N1)C(=O)NCCCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(CSC3=CC=CC=C32)C(=N1)C(=O)NCCCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H31N5OS/c1-29-25-21-10-5-6-11-23(21)33-19-22(25)24(28-29)26(32)27-12-7-13-30-14-16-31(17-15-30)18-20-8-3-2-4-9-20/h2-6,8-11H,7,12-19H2,1H3,(H,27,32)