2-(2,3-dihydroindol-1-yl)-4-[(3,4-dimethylphenyl)methoxy]-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide

Systemtic Name: 2-(2,3-dihydroindol-1-yl)-4-[(3,4-dimethylphenyl)methoxy]-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide Openeye Name: 4-[(3,4-dimethylphenyl)methoxy]-2-indolin-1-yl-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide CAS Name: 2-(2,3-dihydroindol-1-yl)-4-[(3,4-dimethylphenyl)methoxy]-N-(2-oxo-3-azepanyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(2,3-dihydroindol-1-yl)-4-[(3,4-dimethylphenyl)methoxy]-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide Traditional Name: 4-(3,4-dimethylbenzyl)oxy-2-indolin-1-yl-N-(2-ketoazepan-3-yl)pyrimidine-5-carboxamide Formula: C28H31N5O3 MolecularWeight: 485.57744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)COC2=NC(=NC=C2C(=O)NC3CCCCNC3=O)N4CCC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C=C(C=C1)COC2=NC(=NC=C2C(=O)NC3CCCCNC3=O)N4CCC5=CC=CC=C54)C

InChI

InChI=1S/C28H31N5O3/c1-18-10-11-20(15-19(18)2)17-36-27-22(25(34)31-23-8-5-6-13-29-26(23)35)16-30-28(32-27)33-14-12-21-7-3-4-9-24(21)33/h3-4,7,9-11,15-16,23H,5-6,8,12-14,17H2,1-2H3,(H,29,35)(H,31,34)