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

Systemtic Name: 6-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pteridine-2,4-diamine Openeye Name: 6-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pteridine-2,4-diamine CAS Name: 6-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pteridine-2,4-diamine IUPAC Name: 6-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pteridine-2,4-diamine Traditional Name: [2-amino-6-(4,6,7,10-tetrahydrobenzo[b][1]benzazepin-11-ylmethyl)pteridin-4-yl]amine Formula: C21H21N7 MolecularWeight: 371.43834

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2=C1CC=C3CC=CC=C3N2CC4=CN=C5C(=N4)C(=NC(=N5)N)N

Isomeric SMILES

C1C=CCC2=C1CC=C3CC=CC=C3N2CC4=CN=C5C(=N4)C(=NC(=N5)N)N

InChI

InChI=1S/C21H21N7/c22-19-18-20(27-21(23)26-19)24-11-15(25-18)12-28-16-7-3-1-5-13(16)9-10-14-6-2-4-8-17(14)28/h1-4,7,9,11H,5-6,8,10,12H2,(H4,22,23,24,26,27)