5-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pyrimidine-2,4-diamine Openeye Name: 5-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pyrimidine-2,4-diamine CAS Name: 5-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pyrimidine-2,4-diamine IUPAC Name: 5-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pyrimidin-4-yl]amine Formula: C19H21N5 MolecularWeight: 319.40354

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2=C1CC=C3CC=CC=C3N2CC4=CN=C(N=C4N)N

Isomeric SMILES

C1C=CCC2=C1CC=C3CC=CC=C3N2CC4=CN=C(N=C4N)N

InChI

InChI=1S/C19H21N5/c20-18-15(11-22-19(21)23-18)12-24-16-7-3-1-5-13(16)9-10-14-6-2-4-8-17(14)24/h1-4,7,9,11H,5-6,8,10,12H2,(H4,20,21,22,23)