3-methyl-1-(3-methylphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 3-methyl-1-(3-methylphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 3-methyl-1-(3-methylphenyl)-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-3-methyl-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C30H36N6O MolecularWeight: 496.64644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C30H36N6O/c1-24-10-8-13-27(22-24)36-30(35-16-6-7-17-35)28(25(2)32-36)29(37)31-14-9-15-33-18-20-34(21-19-33)23-26-11-4-3-5-12-26/h3-8,10-13,16-17,22H,9,14-15,18-21,23H2,1-2H3,(H,31,37)