1-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one

Systemtic Name: 1-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one Openeye Name: 1-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one CAS Name: 1-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]-3-(methylthio)-6,7-dihydro-5H-2-benzothiophen-4-one IUPAC Name: 1-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one Traditional Name: 1-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]-3-(methylthio)-6,7-dihydro-5H-isobenzothiophen-4-one Formula: C17H21N3OS3 MolecularWeight: 379.56314

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C(=C(S1)C3=NN=C(S3)NC4CCCCC4)CCCC2=O

Isomeric SMILES

CSC1=C2C(=C(S1)C3=NN=C(S3)NC4CCCCC4)CCCC2=O

InChI

InChI=1S/C17H21N3OS3/c1-22-16-13-11(8-5-9-12(13)21)14(23-16)15-19-20-17(24-15)18-10-6-3-2-4-7-10/h10H,2-9H2,1H3,(H,18,20)