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

Systemtic Name: N-(cyclododecylideneamino)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(cyclododecylideneamino)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(cyclododecylideneamino)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(cyclododecylideneamino)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(cyclododecylideneamino)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C28H35N5OS MolecularWeight: 489.6754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)CCCCC1

Isomeric SMILES

C1CCCCCC(=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)CCCCC1

InChI

InChI=1S/C28H35N5OS/c34-26(30-29-24-18-12-6-4-2-1-3-5-7-13-19-24)22-35-28-32-31-27(23-16-10-8-11-17-23)33(28)25-20-14-9-15-21-25/h8-11,14-17,20-21H,1-7,12-13,18-19,22H2,(H,30,34)