N,N-dimethyl-3-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenesulfonamide Openeye Name: 3-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: N,N-dimethyl-3-[[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenesulfonamide Traditional Name: 3-[[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C14H18N4O2S3 MolecularWeight: 370.51332

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NN=C(S2)NCC=C

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NN=C(S2)NCC=C

InChI

InChI=1S/C14H18N4O2S3/c1-4-8-15-13-16-17-14(22-13)21-10-11-6-5-7-12(9-11)23(19,20)18(2)3/h4-7,9H,1,8,10H2,2-3H3,(H,15,16)