3-(4-bromanylthiophen-2-yl)-5-(furan-2-yl)-N-methyl-3H-pyrido[2,3-e][1,4]diazepin-2-amine

Systemtic Name: 3-(4-bromanylthiophen-2-yl)-5-(furan-2-yl)-N-methyl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: 3-(4-bromo-2-thienyl)-5-(2-furyl)-N-methyl-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: 3-(4-bromo-2-thiophenyl)-5-(2-furanyl)-N-methyl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: 3-(4-bromothiophen-2-yl)-5-(furan-2-yl)-N-methyl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: [3-(4-bromo-2-thienyl)-5-(2-furyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]-methyl-amine Formula: C17H13BrN4OS MolecularWeight: 401.28032

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=CC=N2)C(=NC1C3=CC(=CS3)Br)C4=CC=CO4

Isomeric SMILES

CNC1=NC2=C(C=CC=N2)C(=NC1C3=CC(=CS3)Br)C4=CC=CO4

InChI

InChI=1S/C17H13BrN4OS/c1-19-17-15(13-8-10(18)9-24-13)21-14(12-5-3-7-23-12)11-4-2-6-20-16(11)22-17/h2-9,15H,1H3,(H,19,20,22)