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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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