4-(4-methoxyphenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-c]azepine

Systemtic Name: 4-(4-methoxyphenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-c]azepine Openeye Name: 2-isopropyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-c]azepine CAS Name: 4-(4-methoxyphenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-c]azepine IUPAC Name: 4-(4-methoxyphenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-c]azepine Traditional Name: 2-isopropyl-4-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimid[4,5-c]azepine Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C2CCCNCC2=N1)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C1=NC(=C2CCCNCC2=N1)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H23N3O/c1-12(2)18-20-16-11-19-10-4-5-15(16)17(21-18)13-6-8-14(22-3)9-7-13/h6-9,12,19H,4-5,10-11H2,1-3H3