[1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate

Systemtic Name: [1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate Openeye Name: [2-(4-cyanoanilino)-1-methyl-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 [1-(4-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-cyanoanilino)-1-oxopropan-2-yl] 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)acetic acid [2-(4-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)OC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)OC(=O)CC2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C20H17N3O4S/c1-12(19(25)22-14-8-6-13(11-21)7-9-14)27-18(24)10-17-20(26)23-15-4-2-3-5-16(15)28-17/h2-9,12,17H,10H2,1H3,(H,22,25)(H,23,26)