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

Systemtic Name: N-methyl-5-pyridin-3-yl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: N-methyl-5-(3-pyridyl)-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: N-methyl-5-(3-pyridinyl)-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: N-methyl-5-pyridin-3-yl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: methyl-[5-(3-pyridyl)-3-(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=CS3)C4=CN=CC=C4

Isomeric SMILES

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

InChI

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