5-(4-fluorophenyl)-N2-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepine-2,8-diamine

Systemtic Name: 5-(4-fluorophenyl)-N2-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepine-2,8-diamine Openeye Name: 5-(4-fluorophenyl)-N2-methyl-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepine-2,8-diamine CAS Name: 5-(4-fluorophenyl)-N2-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepine-2,8-diamine IUPAC Name: 5-(4-fluorophenyl)-2-N-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepine-2,8-diamine Traditional Name: [8-amino-5-(4-fluorophenyl)-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]-methyl-amine Formula: C19H16FN5S MolecularWeight: 365.427243

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=CC(=N2)N)C(=NC1C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CNC1=NC2=C(C=CC(=N2)N)C(=NC1C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H16FN5S/c1-22-19-17(14-3-2-10-26-14)24-16(11-4-6-12(20)7-5-11)13-8-9-15(21)23-18(13)25-19/h2-10,17H,1H3,(H3,21,22,23,25)