N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-methyl-1-(3-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-methyl-1-(3-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-methyl-1-(3-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-methyl-1-(m-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)NCCCN3CCC4=CC=CC=C4C3)N5C=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)C(=O)NCCCN3CCC4=CC=CC=C4C3)N5C=CC=C5

InChI

InChI=1S/C28H31N5O/c1-21-9-7-12-25(19-21)33-28(32-16-5-6-17-32)26(22(2)30-33)27(34)29-14-8-15-31-18-13-23-10-3-4-11-24(23)20-31/h3-7,9-12,16-17,19H,8,13-15,18,20H2,1-2H3,(H,29,34)