6-carbamimidoyl-N-[2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-6-yl]naphthalene-2-carboxamide

Systemtic Name: 6-carbamimidoyl-N-[2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-6-yl]naphthalene-2-carboxamide Openeye Name: 6-carbamimidoyl-N-[2-(m-tolylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]naphthalene-2-carboxamide CAS Name: 6-carbamimidoyl-N-[2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-6-yl]-2-naphthalenecarboxamide IUPAC Name: 6-carbamimidoyl-N-[2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-6-yl]naphthalene-2-carboxamide Traditional Name: 6-amidino-N-[2-(3-methylbenzyl)-3,4-dihydro-1H-isoquinolin-6-yl]-2-naphthamide Formula: C29H28N4O MolecularWeight: 448.55882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC3=C(C2)C=CC(=C3)NC(=O)C4=CC5=C(C=C4)C=C(C=C5)C(=N)N

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC3=C(C2)C=CC(=C3)NC(=O)C4=CC5=C(C=C4)C=C(C=C5)C(=N)N

InChI

InChI=1S/C29H28N4O/c1-19-3-2-4-20(13-19)17-33-12-11-23-16-27(10-9-26(23)18-33)32-29(34)25-8-6-21-14-24(28(30)31)7-5-22(21)15-25/h2-10,13-16H,11-12,17-18H2,1H3,(H3,30,31)(H,32,34)