10-pyrimidin-5-yl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole

Systemtic Name: 10-pyrimidin-5-yl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole Openeye Name: 10-pyrimidin-5-yl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole CAS Name: 10-(5-pyrimidinyl)-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole IUPAC Name: 10-pyrimidin-5-yl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole Traditional Name: 10-(5-pyrimidyl)-1,2,3,4,5,6-hexahydroazepin[4,5-b]indole Formula: C16H16N4 MolecularWeight: 264.32504

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=C1C3=C(C=CC=C3N2)C4=CN=CN=C4

Isomeric SMILES

C1CNCCC2=C1C3=C(C=CC=C3N2)C4=CN=CN=C4

InChI

InChI=1S/C16H16N4/c1-2-12(11-8-18-10-19-9-11)16-13-4-6-17-7-5-14(13)20-15(16)3-1/h1-3,8-10,17,20H,4-7H2