1-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-2-[(5-prop-2-ynylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-2-[(5-prop-2-ynylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(5-chloro-3-methyl-benzothiophen-2-yl)-2-[(5-prop-2-ynylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone CAS Name: 1-(5-chloro-3-methyl-1-benzothiophen-2-yl)-2-[[5-(prop-2-ynylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(5-chloro-3-methyl-1-benzothiophen-2-yl)-2-[(5-prop-2-ynylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(5-chloro-3-methyl-benzothiophen-2-yl)-2-[[5-(propargylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C16H11ClN2OS4 MolecularWeight: 410.98434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)CSC3=NN=C(S3)SCC#C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)CSC3=NN=C(S3)SCC#C

InChI

InChI=1S/C16H11ClN2OS4/c1-3-6-21-15-18-19-16(24-15)22-8-12(20)14-9(2)11-7-10(17)4-5-13(11)23-14/h1,4-5,7H,6,8H2,2H3