3-butylsulfanyl-4-(1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; ethanedioic acid

Systemtic Name: 3-butylsulfanyl-4-(1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; ethanedioic acid Openeye Name: 3-butylsulfanyl-4-(1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid CAS Name: 3-(butylthio)-4-(1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid IUPAC Name: 3-butylsulfanyl-4-(1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid Traditional Name: 3-(butylthio)-4-(1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid Formula: C15H23N3O4S2 MolecularWeight: 373.49082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NSN=C1C2=CCC(N(C2)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCSC1=NSN=C1C2=CCC(N(C2)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H21N3S2.C2H2O4/c1-4-5-8-17-13-12(14-18-15-13)11-7-6-10(2)16(3)9-11;3-1(4)2(5)6/h7,10H,4-6,8-9H2,1-3H3;(H,3,4)(H,5,6)