N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide CAS Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1-(1H-imidazol-5-ylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Traditional Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1-(1H-imidazol-5-ylsulfonyl)nipecotamide Formula: C13H18N6O3S3 MolecularWeight: 402.51542

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CN3

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CN3

InChI

InChI=1S/C13H18N6O3S3/c1-2-23-13-18-17-12(24-13)16-11(20)9-4-3-5-19(7-9)25(21,22)10-6-14-8-15-10/h6,8-9H,2-5,7H2,1H3,(H,14,15)(H,16,17,20)