3-[(5-cyclopentylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[(5-cyclopentylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[(5-cyclopentylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-benzothiazol-2-one CAS Name: 3-[[5-(cyclopentylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[(5-cyclopentylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-benzothiazol-2-one Traditional Name: 3-[[5-(cyclopentylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2CCCC2)CN3C4=CC=CC=C4SC3=O

Isomeric SMILES

CN1C(=NN=C1SC2CCCC2)CN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C16H18N4OS2/c1-19-14(17-18-15(19)22-11-6-2-3-7-11)10-20-12-8-4-5-9-13(12)23-16(20)21/h4-5,8-9,11H,2-3,6-7,10H2,1H3