N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-besyl-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]propionamide Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S3/c22-16(11-12-27(23,24)15-9-5-2-6-10-15)19-18-21-20-17(26-18)13-25-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,19,21,22)