methanethioyl 3-methyl-7-oxidanylidene-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: methanethioyl 3-methyl-7-oxidanylidene-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: methanethioyl 3-methyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3-methyl-7-oxo-6-[(1-oxo-2-phenylethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methanethioyl ester IUPAC Name: methanethioyl 3-methyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 7-keto-3-methyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid thioformyl ester Formula: C16H16N2O4S2 MolecularWeight: 364.43924

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC=S

Isomeric SMILES

CC1C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC=S

InChI

InChI=1S/C16H16N2O4S2/c1-9-13(16(21)22-8-23)18-14(20)12(15(18)24-9)17-11(19)7-10-5-3-2-4-6-10/h2-6,8-9,12-13,15H,7H2,1H3,(H,17,19)