4-(3-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine

Systemtic Name: 4-(3-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Openeye Name: 4-(3-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine CAS Name: 4-(3-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine IUPAC Name: 4-(3-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Traditional Name: [4-(3-methoxyphenyl)-6,7,8,9-tetrahydro-5H-pyrimid[4,5-b]azepin-2-yl]amine Formula: C15H18N4O MolecularWeight: 270.32962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3CCCCNC3=NC(=N2)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3CCCCNC3=NC(=N2)N

InChI

InChI=1S/C15H18N4O/c1-20-11-6-4-5-10(9-11)13-12-7-2-3-8-17-14(12)19-15(16)18-13/h4-6,9H,2-3,7-8H2,1H3,(H3,16,17,18,19)