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

Systemtic Name: 4-(4-dimethylaminophenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Openeye Name: 4-(4-dimethylaminophenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine CAS Name: 4-(4-dimethylaminophenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine IUPAC Name: 4-(4-dimethylaminophenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Traditional Name: [4-(2-amino-6,7,8,9-tetrahydro-5H-pyrimid[4,5-b]azepin-4-yl)phenyl]-dimethyl-amine Formula: C16H21N5 MolecularWeight: 283.37144

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C3CCCCNC3=NC(=N2)N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C3CCCCNC3=NC(=N2)N

InChI

InChI=1S/C16H21N5/c1-21(2)12-8-6-11(7-9-12)14-13-5-3-4-10-18-15(13)20-16(17)19-14/h6-9H,3-5,10H2,1-2H3,(H3,17,18,19,20)