N-(3-methylsulfanylphenyl)-3-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]propanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-3-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]propanamide Openeye Name: N-(3-methylsulfanylphenyl)-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]propanamide CAS Name: N-[3-(methylthio)phenyl]-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]propanamide IUPAC Name: N-(3-methylsulfanylphenyl)-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]propanamide Traditional Name: 3-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonylamino]-N-[3-(methylthio)phenyl]propionamide Formula: C17H17N3O5S2 MolecularWeight: 407.46398

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C17H17N3O5S2/c1-26-12-4-2-3-11(9-12)19-16(21)7-8-18-27(23,24)13-5-6-14-15(10-13)25-17(22)20-14/h2-6,9-10,18H,7-8H2,1H3,(H,19,21)(H,20,22)