N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: 3-(3-oxo-1,4-benzothiazin-4-yl)-N-[(S)-p-tolyl(2-thienyl)methyl]propanamide CAS Name: N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)-N-[(S)-p-tolyl(2-thienyl)methyl]propionamide Formula: C23H22N2O2S2 MolecularWeight: 422.56298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C23H22N2O2S2/c1-16-8-10-17(11-9-16)23(20-7-4-14-28-20)24-21(26)12-13-25-18-5-2-3-6-19(18)29-15-22(25)27/h2-11,14,23H,12-13,15H2,1H3,(H,24,26)/t23-/m0/s1