3-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-1-(azepan-1-yl)propan-1-one

Systemtic Name: 3-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-1-(azepan-1-yl)propan-1-one Openeye Name: 3-(4-amino-6-anilino-1,3,5-triazin-2-yl)-1-(azepan-1-yl)propan-1-one CAS Name: 3-(4-amino-6-anilino-1,3,5-triazin-2-yl)-1-(1-azepanyl)-1-propanone IUPAC Name: 3-(4-amino-6-anilino-1,3,5-triazin-2-yl)-1-(azepan-1-yl)propan-1-one Traditional Name: 3-(4-amino-6-anilino-s-triazin-2-yl)-1-(azepan-1-yl)propan-1-one Formula: C18H24N6O MolecularWeight: 340.42276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

C1CCCN(CC1)C(=O)CCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H24N6O/c19-17-21-15(10-11-16(25)24-12-6-1-2-7-13-24)22-18(23-17)20-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13H2,(H3,19,20,21,22,23)