5-(6-azanylpyridin-3-yl)-N-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine

Systemtic Name: 5-(6-azanylpyridin-3-yl)-N-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: 5-(6-amino-3-pyridyl)-N-methyl-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: 5-(6-amino-3-pyridinyl)-N-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: 5-(6-aminopyridin-3-yl)-N-methyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: [5-(6-amino-3-pyridyl)-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]-methyl-amine Formula: C18H16N6S MolecularWeight: 348.42484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N6S/c1-20-18-16(13-5-3-9-25-13)23-15(11-6-7-14(19)22-10-11)12-4-2-8-21-17(12)24-18/h2-10,16H,1H3,(H2,19,22)(H,20,21,24)