N-[5-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide

Systemtic Name: N-[5-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide Openeye Name: N-[5-[2-(3-acetamidoanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide CAS Name: N-[5-[[2-(3-acetamidoanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-methylbenzamide IUPAC Name: N-[5-[2-(3-acetamidoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide Traditional Name: N-[5-[[2-(3-acetamidoanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide Formula: C20H19N5O3S2 MolecularWeight: 441.52656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C20H19N5O3S2/c1-12-6-3-4-9-16(12)18(28)23-19-24-25-20(30-19)29-11-17(27)22-15-8-5-7-14(10-15)21-13(2)26/h3-10H,11H2,1-2H3,(H,21,26)(H,22,27)(H,23,24,28)