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

Systemtic Name: 4-(4-chlorophenyl)-2-methyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine Openeye Name: 4-(4-chlorophenyl)-2-methyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine CAS Name: 4-(4-chlorophenyl)-2-methyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine IUPAC Name: 4-(4-chlorophenyl)-2-methyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine Traditional Name: 4-(4-chlorophenyl)-2-methyl-6,7,8,9-tetrahydro-5H-pyrimid[4,5-d]azepine Formula: C15H16ClN3 MolecularWeight: 273.76064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2CCNCCC2=N1)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC(=C2CCNCCC2=N1)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H16ClN3/c1-10-18-14-7-9-17-8-6-13(14)15(19-10)11-2-4-12(16)5-3-11/h2-5,17H,6-9H2,1H3