[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[(2R)-3-keto-4H-1,4-benzothiazin-2-yl]acetic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)CC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C[C@@H]1C(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C18H23N3O5S/c1-11(2)7-8-19-18(25)21-15(22)10-26-16(23)9-14-17(24)20-12-5-3-4-6-13(12)27-14/h3-6,11,14H,7-10H2,1-2H3,(H,20,24)(H2,19,21,22,25)/t14-/m1/s1