2-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-piperidinosulfonyl-benzamide Formula: C16H19ClN4O3S3 MolecularWeight: 446.99506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN4O3S3/c1-2-25-16-20-19-15(26-16)18-14(22)12-10-11(6-7-13(12)17)27(23,24)21-8-4-3-5-9-21/h6-7,10H,2-5,8-9H2,1H3,(H,18,19,22)