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

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H23N5OS2 MolecularWeight: 401.54882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NC3=NC(=CS3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NC3=NC(=CS3)C(C)(C)C

InChI

InChI=1S/C19H23N5OS2/c1-12-6-5-7-13(10-12)16-22-23-18(26)24(16)9-8-15(25)21-17-20-14(11-27-17)19(2,3)4/h5-7,10-11H,8-9H2,1-4H3,(H,23,26)(H,20,21,25)