5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-[(2-ethylmorpholin-4-yl)methyl]-4-methyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-[(2-ethylmorpholin-4-yl)methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-[(2-ethylmorpholin-4-yl)methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-2-[(2-ethyl-4-morpholinyl)methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-[(2-ethylmorpholin-4-yl)methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-2-[(2-ethylmorpholino)methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C18H23N5OS3 MolecularWeight: 421.60312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)CN2C(=S)N(C(=N2)CSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCC1CN(CCO1)CN2C(=S)N(C(=N2)CSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C18H23N5OS3/c1-3-13-10-22(8-9-24-13)12-23-18(25)21(2)16(20-23)11-26-17-19-14-6-4-5-7-15(14)27-17/h4-7,13H,3,8-12H2,1-2H3