N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C20H19N5OS2 MolecularWeight: 409.52776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N5OS2/c1-2-6-17-23-24-20(27)25(17)12-18(26)21-14-8-5-7-13(11-14)19-22-15-9-3-4-10-16(15)28-19/h3-5,7-11H,2,6,12H2,1H3,(H,21,26)(H,24,27)