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

Systemtic Name: ethyl 2-(6,7-dimethyl-2-oxidanylidene-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-1-yl)propanoate Openeye Name: ethyl 2-(6,7-dimethyl-2-oxo-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-1-yl)propanoate CAS Name: 2-(6,7-dimethyl-2-oxo-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-1-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(6,7-dimethyl-2-oxo-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-1-yl)propanoate Traditional Name: 2-(2-keto-6,7-dimethyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-1-yl)propionic acid ethyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C(=O)CN=C(C2=C1SC(=C2C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C)N1C(=O)CN=C(C2=C1SC(=C2C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-5-25-20(24)13(3)22-16(23)11-21-18(15-9-7-6-8-10-15)17-12(2)14(4)26-19(17)22/h6-10,13H,5,11H2,1-4H3