N-(6-azanyl-1,3-benzothiazol-2-yl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: N-(6-azanyl-1,3-benzothiazol-2-yl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C12H12N6OS2 MolecularWeight: 320.39328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)SC(=N2)NC(=O)CCSC3=NC=NN3

Isomeric SMILES

C1=CC2=C(C=C1N)SC(=N2)NC(=O)CCSC3=NC=NN3

InChI

InChI=1S/C12H12N6OS2/c13-7-1-2-8-9(5-7)21-12(16-8)17-10(19)3-4-20-11-14-6-15-18-11/h1-2,5-6H,3-4,13H2,(H,14,15,18)(H,16,17,19)