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

Systemtic Name: 4-(phenylmethyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Openeye Name: 4-benzyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine CAS Name: 4-(phenylmethyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine IUPAC Name: 4-benzyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Traditional Name: (4-benzyl-6,7,8,9-tetrahydro-5H-pyrimid[4,5-b]azepin-2-yl)amine Formula: C15H18N4 MolecularWeight: 254.33022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC2=NC(=NC(=C2C1)CC3=CC=CC=C3)N

Isomeric SMILES

C1CCNC2=NC(=NC(=C2C1)CC3=CC=CC=C3)N

InChI

InChI=1S/C15H18N4/c16-15-18-13(10-11-6-2-1-3-7-11)12-8-4-5-9-17-14(12)19-15/h1-3,6-7H,4-5,8-10H2,(H3,16,17,18,19)