2-ethylsulfanyl-5-methyl-N,7-diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

Systemtic Name: 2-ethylsulfanyl-5-methyl-N,7-diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: 2-ethylsulfanyl-5-methyl-N,7-diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: 2-(ethylthio)-5-methyl-N,7-diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide IUPAC Name: 2-ethylsulfanyl-5-methyl-N,7-diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: 2-(ethylthio)-5-methyl-N,7-diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=NC(=C(C(N2N1)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CCSC1=NC2=NC(=C(C(N2N1)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C21H21N5OS/c1-3-28-21-24-20-22-14(2)17(19(27)23-16-12-8-5-9-13-16)18(26(20)25-21)15-10-6-4-7-11-15/h4-13,18H,3H2,1-2H3,(H,23,27)(H,22,24,25)