4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-1-yl)pyrimidine-5-carboxamide

Systemtic Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-1-yl)pyrimidine-5-carboxamide Openeye Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methylindolin-1-yl)-N-(2-oxoazepan-1-yl)pyrimidine-5-carboxamide CAS Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-oxo-1-azepanyl)-5-pyrimidinecarboxamide IUPAC Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-oxoazepan-1-yl)pyrimidine-5-carboxamide Traditional Name: N-(2-ketoazepan-1-yl)-2-(2-methylindolin-1-yl)-4-(p-anisylamino)pyrimidine-5-carboxamide Formula: C28H32N6O3 MolecularWeight: 500.59208

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C(=N3)NCC4=CC=C(C=C4)OC)C(=O)NN5CCCCCC5=O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC=C(C(=N3)NCC4=CC=C(C=C4)OC)C(=O)NN5CCCCCC5=O

InChI

InChI=1S/C28H32N6O3/c1-19-16-21-8-5-6-9-24(21)34(19)28-30-18-23(27(36)32-33-15-7-3-4-10-25(33)35)26(31-28)29-17-20-11-13-22(37-2)14-12-20/h5-6,8-9,11-14,18-19H,3-4,7,10,15-17H2,1-2H3,(H,32,36)(H,29,30,31)