2-cyclopentyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine

Systemtic Name: 2-cyclopentyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine Openeye Name: 2-cyclopentyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine CAS Name: 2-cyclopentyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine IUPAC Name: 2-cyclopentyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine Traditional Name: 2-cyclopentyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimid[4,5-d]azepine Formula: C20H25N3O MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3CCNCCC3=NC(=N2)C4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3CCNCCC3=NC(=N2)C4CCCC4

InChI

InChI=1S/C20H25N3O/c1-24-16-8-6-14(7-9-16)19-17-10-12-21-13-11-18(17)22-20(23-19)15-4-2-3-5-15/h6-9,15,21H,2-5,10-13H2,1H3