2-(isoquinolin-3-ylamino)-N-(3-oxidanylpropyl)-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-(isoquinolin-3-ylamino)-N-(3-oxidanylpropyl)-1H-benzimidazole-4-carboxamide Openeye Name: N-(3-hydroxypropyl)-2-(3-isoquinolylamino)-1H-benzimidazole-4-carboxamide CAS Name: N-(3-hydroxypropyl)-2-(3-isoquinolinylamino)-1H-benzimidazole-4-carboxamide IUPAC Name: N-(3-hydroxypropyl)-2-(isoquinolin-3-ylamino)-1H-benzimidazole-4-carboxamide Traditional Name: N-(3-hydroxypropyl)-2-(3-isoquinolylamino)-1H-benzimidazole-4-carboxamide Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)NC3=NC4=C(C=CC=C4N3)C(=O)NCCCO

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)NC3=NC4=C(C=CC=C4N3)C(=O)NCCCO

InChI

InChI=1S/C20H19N5O2/c26-10-4-9-21-19(27)15-7-3-8-16-18(15)25-20(23-16)24-17-11-13-5-1-2-6-14(13)12-22-17/h1-3,5-8,11-12,26H,4,9-10H2,(H,21,27)(H2,22,23,24,25)