2-(4-piperidin-1-ylsulfonylphenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(4-piperidin-1-ylsulfonylphenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-piperidin-1-ylsulfonylphenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-2-(4-piperidinosulfonylphenyl)acetamide Formula: C18H22N4O3S3 MolecularWeight: 438.58728

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(S1)NC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C=CCSC1=NN=C(S1)NC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N4O3S3/c1-2-12-26-18-21-20-17(27-18)19-16(23)13-14-6-8-15(9-7-14)28(24,25)22-10-4-3-5-11-22/h2,6-9H,1,3-5,10-13H2,(H,19,20,23)