N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-prop-2-ynyl-3-(thiophen-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-prop-2-ynyl-3-(thiophen-2-ylsulfanylmethyl)benzamide Openeye Name: N-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-prop-2-ynyl-3-(2-thienylsulfanylmethyl)benzamide CAS Name: N-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-prop-2-ynyl-3-[(thiophen-2-ylthio)methyl]benzamide IUPAC Name: N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-prop-2-ynyl-3-(thiophen-2-ylsulfanylmethyl)benzamide Traditional Name: N-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-propargyl-3-[(2-thienylthio)methyl]benzamide Formula: C20H18N2O4S3 MolecularWeight: 446.56292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N(CC#C)C(=O)C2=CC(=CC=C2)CSC3=CC=CS3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N(CC#C)C(=O)C2=CC(=CC=C2)CSC3=CC=CS3

InChI

InChI=1S/C20H18N2O4S3/c1-4-10-22(29(24,25)19-14(2)21-26-15(19)3)20(23)17-8-5-7-16(12-17)13-28-18-9-6-11-27-18/h1,5-9,11-12H,10,13H2,2-3H3