N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-(besylmethyl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S3/c1-2-25-18-21-20-17(26-18)19-16(22)14-8-6-7-13(11-14)12-27(23,24)15-9-4-3-5-10-15/h3-11H,2,12H2,1H3,(H,19,20,22)