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

Systemtic Name: 2-(7-methyl-2-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)ethanenitrile Openeye Name: 2-[7-methyl-2-oxo-5-(2-thienyl)-3H-thieno[2,3-e][1,4]diazepin-1-yl]acetonitrile CAS Name: 2-(7-methyl-2-oxo-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)acetonitrile IUPAC Name: 2-(7-methyl-2-oxo-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-1-yl)acetonitrile Traditional Name: 2-[2-keto-7-methyl-5-(2-thienyl)-3H-thieno[2,3-e][1,4]diazepin-1-yl]acetonitrile Formula: C14H11N3OS2 MolecularWeight: 301.38664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N(C(=O)CN=C2C3=CC=CS3)CC#N

Isomeric SMILES

CC1=CC2=C(S1)N(C(=O)CN=C2C3=CC=CS3)CC#N

InChI

InChI=1S/C14H11N3OS2/c1-9-7-10-13(11-3-2-6-19-11)16-8-12(18)17(5-4-15)14(10)20-9/h2-3,6-7H,5,8H2,1H3