1-[8-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethoxy]quinolin-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[8-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethoxy]quinolin-2-yl]piperidine-4-carboxamide Openeye Name: 1-[8-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethoxy]-2-quinolyl]piperidine-4-carboxamide CAS Name: 1-[8-[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethoxy]-2-quinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[8-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethoxy]quinolin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[8-[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethoxy]-2-quinolyl]isonipecotamide Formula: C21H24N6O3S2 MolecularWeight: 472.58366

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)COC2=CC=CC3=C2N=C(C=C3)N4CCC(CC4)C(=O)N

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)COC2=CC=CC3=C2N=C(C=C3)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C21H24N6O3S2/c1-2-31-21-26-25-20(32-21)24-17(28)12-30-15-5-3-4-13-6-7-16(23-18(13)15)27-10-8-14(9-11-27)19(22)29/h3-7,14H,2,8-12H2,1H3,(H2,22,29)(H,24,25,28)