[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)acetic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)CC2C(=O)NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)CC2C(=O)NC3=CC=CC=C3S2)C

InChI

InChI=1S/C20H20N2O4S/c1-12-7-13(2)9-14(8-12)21-18(23)11-26-19(24)10-17-20(25)22-15-5-3-4-6-16(15)27-17/h3-9,17H,10-11H2,1-2H3,(H,21,23)(H,22,25)