N-(4-tert-butyl-1,3-thiazol-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C20H25N5O2S2 MolecularWeight: 431.5748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3=NC(=CS3)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3=NC(=CS3)C(C)(C)C

InChI

InChI=1S/C20H25N5O2S2/c1-5-27-14-8-6-13(7-9-14)17-23-24-19(28)25(17)11-10-16(26)22-18-21-15(12-29-18)20(2,3)4/h6-9,12H,5,10-11H2,1-4H3,(H,24,28)(H,21,22,26)