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

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] 2-(3-oxo-1,4-benzothiazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(3-oxo-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)CN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)CN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C19H21N3O4S/c20-13-19(8-4-1-5-9-19)21-16(23)11-26-18(25)10-22-14-6-2-3-7-15(14)27-12-17(22)24/h2-3,6-7H,1,4-5,8-12H2,(H,21,23)