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

Systemtic Name: N-[5-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide Openeye Name: N-[5-[2-(3,5-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide CAS Name: N-[5-[[2-(3,5-dimethylanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-3,5-dimethylbenzamide IUPAC Name: N-[5-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,5-dimethylbenzamide Traditional Name: N-[5-[[2-(3,5-dimethylanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC(=CC(=C3)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC(=CC(=C3)C)C)C

InChI

InChI=1S/C21H22N4O2S2/c1-12-5-13(2)8-16(7-12)19(27)23-20-24-25-21(29-20)28-11-18(26)22-17-9-14(3)6-15(4)10-17/h5-10H,11H2,1-4H3,(H,22,26)(H,23,24,27)