5-[2-(methylamino)-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-3-yl]thiophene-3-carbonitrile

Systemtic Name: 5-[2-(methylamino)-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-3-yl]thiophene-3-carbonitrile Openeye Name: 5-[2-(methylamino)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-3-yl]thiophene-3-carbonitrile CAS Name: 5-[2-(methylamino)-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-3-yl]-3-thiophenecarbonitrile IUPAC Name: 5-[2-(methylamino)-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-3-yl]thiophene-3-carbonitrile Traditional Name: 5-[2-(methylamino)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-3-yl]thiophene-3-carbonitrile Formula: C18H13N5S2 MolecularWeight: 363.45932

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=CC=N2)C(=NC1C3=CC(=CS3)C#N)C4=CC=CS4

Isomeric SMILES

CNC1=NC2=C(C=CC=N2)C(=NC1C3=CC(=CS3)C#N)C4=CC=CS4

InChI

InChI=1S/C18H13N5S2/c1-20-18-16(14-8-11(9-19)10-25-14)22-15(13-5-3-7-24-13)12-4-2-6-21-17(12)23-18/h2-8,10,16H,1H3,(H,20,21,23)