N-cyclohexyl-4-methyl-2-(4-methyl-2-phenyl-7,8-dihydropyrimido[4,5-b]azepin-9-yl)pentanamide

Systemtic Name: N-cyclohexyl-4-methyl-2-(4-methyl-2-phenyl-7,8-dihydropyrimido[4,5-b]azepin-9-yl)pentanamide Openeye Name: N-cyclohexyl-4-methyl-2-(4-methyl-2-phenyl-7,8-dihydropyrimido[4,5-b]azepin-9-yl)pentanamide CAS Name: N-cyclohexyl-4-methyl-2-(4-methyl-2-phenyl-7,8-dihydropyrimido[4,5-b]azepin-9-yl)pentanamide IUPAC Name: N-cyclohexyl-4-methyl-2-(4-methyl-2-phenyl-7,8-dihydropyrimido[4,5-b]azepin-9-yl)pentanamide Traditional Name: N-cyclohexyl-4-methyl-2-(4-methyl-2-phenyl-7,8-dihydropyrimid[4,5-b]azepin-9-yl)valeramide Formula: C27H36N4O MolecularWeight: 432.60094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CCCN(C2=NC(=N1)C3=CC=CC=C3)C(CC(C)C)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=C2C=CCCN(C2=NC(=N1)C3=CC=CC=C3)C(CC(C)C)C(=O)NC4CCCCC4

InChI

InChI=1S/C27H36N4O/c1-19(2)18-24(27(32)29-22-14-8-5-9-15-22)31-17-11-10-16-23-20(3)28-25(30-26(23)31)21-12-6-4-7-13-21/h4,6-7,10,12-13,16,19,22,24H,5,8-9,11,14-15,17-18H2,1-3H3,(H,29,32)