methyl 3-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[1-oxo-2-(3-oxo-4H-1,4-benzothiazin-2-yl)ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-(3-keto-4H-1,4-benzothiazin-2-yl)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O4S/c1-26-19(24)11-15(13-7-3-2-4-8-13)21-18(23)12-17-20(25)22-14-9-5-6-10-16(14)27-17/h2-10,15,17H,11-12H2,1H3,(H,21,23)(H,22,25)