1-[3-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-1,2,4-thiadiazol-5-yl]-3-(4-ethoxyphenyl)urea

Systemtic Name: 1-[3-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-1,2,4-thiadiazol-5-yl]-3-(4-ethoxyphenyl)urea Openeye Name: 1-[3-(3,3-dimethyl-2-oxo-butyl)sulfanyl-1,2,4-thiadiazol-5-yl]-3-(4-ethoxyphenyl)urea CAS Name: 1-[3-[(3,3-dimethyl-2-oxobutyl)thio]-1,2,4-thiadiazol-5-yl]-3-(4-ethoxyphenyl)urea IUPAC Name: 1-[3-(3,3-dimethyl-2-oxobutyl)sulfanyl-1,2,4-thiadiazol-5-yl]-3-(4-ethoxyphenyl)urea Traditional Name: 1-[3-[(2-keto-3,3-dimethyl-butyl)thio]-1,2,4-thiadiazol-5-yl]-3-p-phenetyl-urea Formula: C17H22N4O3S2 MolecularWeight: 394.51158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=NC(=NS2)SCC(=O)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=NC(=NS2)SCC(=O)C(C)(C)C

InChI

InChI=1S/C17H22N4O3S2/c1-5-24-12-8-6-11(7-9-12)18-14(23)19-15-20-16(21-26-15)25-10-13(22)17(2,3)4/h6-9H,5,10H2,1-4H3,(H2,18,19,20,21,23)