N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-[4-(2-methoxy-5-methylphenyl)-2-thiazolyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)-N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]propionamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C22H21N3O3S2/c1-14-7-8-18(28-2)15(11-14)16-12-30-22(23-16)24-20(26)9-10-25-17-5-3-4-6-19(17)29-13-21(25)27/h3-8,11-12H,9-10,13H2,1-2H3,(H,23,24,26)