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

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(1-piperidyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-(1-piperidinyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-piperidino-3-piperidinosulfonyl-benzamide Formula: C21H29N5O3S3 MolecularWeight: 495.68166

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H29N5O3S3/c1-2-30-21-24-23-20(31-21)22-19(27)16-9-10-17(25-11-5-3-6-12-25)18(15-16)32(28,29)26-13-7-4-8-14-26/h9-10,15H,2-8,11-14H2,1H3,(H,22,23,27)