2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(pentan-3-ylideneamino)ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(pentan-3-ylideneamino)ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-ethylpropylideneamino)acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(pentan-3-ylideneamino)acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(pentan-3-ylideneamino)acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(1-ethylpropylideneamino)acetamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3)CC

Isomeric SMILES

CCC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H23N5OS/c1-3-17(4-2)22-23-19(27)15-28-21-25-24-20(16-11-7-5-8-12-16)26(21)18-13-9-6-10-14-18/h5-14H,3-4,15H2,1-2H3,(H,23,27)