[4-[2-[5-(2-chlorophenyl)-3-methyl-2-oxidanylidene-3H-thieno[2,3-e][1,4]diazepin-1-yl]ethyl]phenyl]methyl ethanoate

Systemtic Name: [4-[2-[5-(2-chlorophenyl)-3-methyl-2-oxidanylidene-3H-thieno[2,3-e][1,4]diazepin-1-yl]ethyl]phenyl]methyl ethanoate Openeye Name: [4-[2-[5-(2-chlorophenyl)-3-methyl-2-oxo-3H-thieno[2,3-e][1,4]diazepin-1-yl]ethyl]phenyl]methyl acetate CAS Name: acetic acid [4-[2-[5-(2-chlorophenyl)-3-methyl-2-oxo-3H-thieno[2,3-e][1,4]diazepin-1-yl]ethyl]phenyl]methyl ester IUPAC Name: [4-[2-[5-(2-chlorophenyl)-3-methyl-2-oxo-3H-thieno[2,3-e][1,4]diazepin-1-yl]ethyl]phenyl]methyl acetate Traditional Name: acetic acid [4-[2-[5-(2-chlorophenyl)-2-keto-3-methyl-3H-thieno[2,3-e][1,4]diazepin-1-yl]ethyl]benzyl] ester Formula: C25H23ClN2O3S MolecularWeight: 466.97972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(C=CS2)C(=N1)C3=CC=CC=C3Cl)CCC4=CC=C(C=C4)COC(=O)C

Isomeric SMILES

CC1C(=O)N(C2=C(C=CS2)C(=N1)C3=CC=CC=C3Cl)CCC4=CC=C(C=C4)COC(=O)C

InChI

InChI=1S/C25H23ClN2O3S/c1-16-24(30)28(13-11-18-7-9-19(10-8-18)15-31-17(2)29)25-21(12-14-32-25)23(27-16)20-5-3-4-6-22(20)26/h3-10,12,14,16H,11,13,15H2,1-2H3