N-(2-methylsulfonylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methylsulfonylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methylsulfonylphenyl)acetamide CAS Name: N-(2-methylsulfonylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(2-methylsulfonylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-mesylphenyl)acetamide Formula: C14H16N4O3S3 MolecularWeight: 384.49684

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NC(=O)CSC2=NN=C(S2)NCC=C

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NC(=O)CSC2=NN=C(S2)NCC=C

InChI

InChI=1S/C14H16N4O3S3/c1-3-8-15-13-17-18-14(23-13)22-9-12(19)16-10-6-4-5-7-11(10)24(2,20)21/h3-7H,1,8-9H2,2H3,(H,15,17)(H,16,19)