2-(1,3-benzothiazol-2-yl)-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-4H-pyrazol-3-one IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-2-pyrazolin-3-one Formula: C14H11N5OS3 MolecularWeight: 361.46504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC2=NN(C(=O)C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NN=C(S1)SCC2=NN(C(=O)C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C14H11N5OS3/c1-8-16-17-14(22-8)21-7-9-6-12(20)19(18-9)13-15-10-4-2-3-5-11(10)23-13/h2-5H,6-7H2,1H3