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

Systemtic Name: N-ethyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: N-ethyl-3-(4-pyridyl)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: N-ethyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: N-ethyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: ethyl-[3-(4-pyridyl)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]amine Formula: C19H17N5S MolecularWeight: 347.43678

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C=CC=N2)C(=NC1C3=CC=NC=C3)C4=CC=CS4

Isomeric SMILES

CCNC1=NC2=C(C=CC=N2)C(=NC1C3=CC=NC=C3)C4=CC=CS4

InChI

InChI=1S/C19H17N5S/c1-2-21-19-16(13-7-10-20-11-8-13)23-17(15-6-4-12-25-15)14-5-3-9-22-18(14)24-19/h3-12,16H,2H2,1H3,(H,21,22,24)