N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(phenylsulfonylamino)propanamide

Systemtic Name: N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(phenylsulfonylamino)propanamide Openeye Name: 3-(benzenesulfonamido)-N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(benzenesulfonamido)-N-[5-[(phenylmethylthio)methyl]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(benzenesulfonamido)-N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-(benzenesulfonamido)-N-[5-[(benzylthio)methyl]-1,3,4-thiadiazol-2-yl]propionamide Formula: C19H20N4O3S3 MolecularWeight: 448.5821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O3S3/c24-17(11-12-20-29(25,26)16-9-5-2-6-10-16)21-19-23-22-18(28-19)14-27-13-15-7-3-1-4-8-15/h1-10,20H,11-14H2,(H,21,23,24)