azanyl 2-[5-(3-cyclohexa-1,3-dien-1-yl-2-sulfanyl-propanoyl)-4-oxidanylidene-2-phenyl-2H-1,3-thiazin-3-yl]ethanoate

Systemtic Name: azanyl 2-[5-(3-cyclohexa-1,3-dien-1-yl-2-sulfanyl-propanoyl)-4-oxidanylidene-2-phenyl-2H-1,3-thiazin-3-yl]ethanoate Openeye Name: amino 2-[5-(3-cyclohexa-1,3-dien-1-yl-2-sulfanyl-propanoyl)-4-oxo-2-phenyl-2H-1,3-thiazin-3-yl]acetate CAS Name: 2-[5-[3-(1-cyclohexa-1,3-dienyl)-2-mercapto-1-oxopropyl]-4-oxo-2-phenyl-2H-1,3-thiazin-3-yl]acetic acid amino ester IUPAC Name: amino 2-[5-(3-cyclohexa-1,3-dien-1-yl-2-sulfanylpropanoyl)-4-oxo-2-phenyl-2H-1,3-thiazin-3-yl]acetate Traditional Name: 2-[5-(3-cyclohexa-1,3-dien-1-yl-2-mercapto-propanoyl)-4-keto-2-phenyl-2H-1,3-thiazin-3-yl]acetic acid amino ester Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)CC(C(=O)C2=CSC(N(C2=O)CC(=O)ON)C3=CC=CC=C3)S

Isomeric SMILES

C1CC(=CC=C1)CC(C(=O)C2=CSC(N(C2=O)CC(=O)ON)C3=CC=CC=C3)S

InChI

InChI=1S/C21H22N2O4S2/c22-27-18(24)12-23-20(26)16(13-29-21(23)15-9-5-2-6-10-15)19(25)17(28)11-14-7-3-1-4-8-14/h1-3,5-7,9-10,13,17,21,28H,4,8,11-12,22H2