N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]isoquinoline-3-carboxamide

Systemtic Name: N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]isoquinoline-3-carboxamide Openeye Name: N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]isoquinoline-3-carboxamide CAS Name: N-cyclopropyl-N-[[3-[4-(1-pyrrolidinyl)-6-quinazolinyl]phenyl]methyl]-3-isoquinolinecarboxamide IUPAC Name: N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]isoquinoline-3-carboxamide Traditional Name: N-cyclopropyl-N-[3-(4-pyrrolidinoquinazolin-6-yl)benzyl]isoquinoline-3-carboxamide Formula: C32H29N5O MolecularWeight: 499.60556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)C6=CC7=CC=CC=C7C=N6

Isomeric SMILES

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)C6=CC7=CC=CC=C7C=N6

InChI

InChI=1S/C32H29N5O/c38-32(30-18-24-7-1-2-8-26(24)19-33-30)37(27-11-12-27)20-22-6-5-9-23(16-22)25-10-13-29-28(17-25)31(35-21-34-29)36-14-3-4-15-36/h1-2,5-10,13,16-19,21,27H,3-4,11-12,14-15,20H2