N-[2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-phenyl-cyclopropane-1-carboxamide

Systemtic Name: N-[2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-phenyl-cyclopropane-1-carboxamide Openeye Name: N-[2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-phenyl-cyclopropanecarboxamide CAS Name: N-[2-[(E)-3-(1H-imidazol-5-yl)-1-oxoprop-2-enyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-phenyl-1-cyclopropanecarboxamide IUPAC Name: N-[2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-phenylcyclopropane-1-carboxamide Traditional Name: N-[2-[(E)-3-(1H-imidazol-5-yl)acryloyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-phenyl-cyclopropanecarboxamide Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)C(=O)C=CC5=CN=CN5

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)C(=O)/C=C/C5=CN=CN5

InChI

InChI=1S/C25H24N4O2/c30-23(9-8-22-15-26-17-27-22)29-13-10-18-6-7-21(14-19(18)16-29)28-24(31)25(11-12-25)20-4-2-1-3-5-20/h1-9,14-15,17H,10-13,16H2,(H,26,27)(H,28,31)/b9-8+