2-(6,7-dimethyl-2-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)ethanenitrile

Systemtic Name: 2-(6,7-dimethyl-2-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)ethanenitrile Openeye Name: 2-[6,7-dimethyl-2-oxo-5-(2-thienyl)-3H-thieno[2,3-e][1,4]diazepin-1-yl]acetonitrile CAS Name: 2-(6,7-dimethyl-2-oxo-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)acetonitrile IUPAC Name: 2-(6,7-dimethyl-2-oxo-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)acetonitrile Traditional Name: 2-[2-keto-6,7-dimethyl-5-(2-thienyl)-3H-thieno[2,3-e][1,4]diazepin-1-yl]acetonitrile Formula: C15H13N3OS2 MolecularWeight: 315.41322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NCC(=O)N2CC#N)C3=CC=CS3)C

Isomeric SMILES

CC1=C(SC2=C1C(=NCC(=O)N2CC#N)C3=CC=CS3)C

InChI

InChI=1S/C15H13N3OS2/c1-9-10(2)21-15-13(9)14(11-4-3-7-20-11)17-8-12(19)18(15)6-5-16/h3-4,7H,6,8H2,1-2H3