N-methyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine

Systemtic Name: N-methyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: N-methyl-3-(4-pyridyl)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: N-methyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: N-methyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: methyl-[3-(4-pyridyl)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]amine Formula: C18H15N5S MolecularWeight: 333.4102

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=CC=N2)C(=NC1C3=CC=NC=C3)C4=CC=CS4

Isomeric SMILES

CNC1=NC2=C(C=CC=N2)C(=NC1C3=CC=NC=C3)C4=CC=CS4

InChI

InChI=1S/C18H15N5S/c1-19-18-15(12-6-9-20-10-7-12)22-16(14-5-3-11-24-14)13-4-2-8-21-17(13)23-18/h2-11,15H,1H3,(H,19,21,23)