4-butyl-N-[5-(phenylmethyl)sulfonyl-1,3,4-thiadiazol-2-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[5-(phenylmethyl)sulfonyl-1,3,4-thiadiazol-2-yl]cyclohexane-1-carboxamide Openeye Name: N-(5-benzylsulfonyl-1,3,4-thiadiazol-2-yl)-4-butyl-cyclohexanecarboxamide CAS Name: 4-butyl-N-[5-(phenylmethyl)sulfonyl-1,3,4-thiadiazol-2-yl]-1-cyclohexanecarboxamide IUPAC Name: N-(5-benzylsulfonyl-1,3,4-thiadiazol-2-yl)-4-butylcyclohexane-1-carboxamide Traditional Name: N-(5-benzylsulfonyl-1,3,4-thiadiazol-2-yl)-4-butyl-cyclohexanecarboxamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O3S2/c1-2-3-7-15-10-12-17(13-11-15)18(24)21-19-22-23-20(27-19)28(25,26)14-16-8-5-4-6-9-16/h4-6,8-9,15,17H,2-3,7,10-14H2,1H3,(H,21,22,24)