N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C21H28N4O3S2 MolecularWeight: 448.60202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S2/c1-3-17(4-2)20-23-24-21(29-20)22-19(26)18-10-13-25(14-11-18)30(27,28)15-12-16-8-6-5-7-9-16/h5-9,12,15,17-18H,3-4,10-11,13-14H2,1-2H3,(H,22,24,26)/b15-12+