[2-[6-(dipropylamino)hexylsulfanyl]pyridin-3-yl]-thiophen-2-yl-methanone; ethanedioic acid

Systemtic Name: [2-[6-(dipropylamino)hexylsulfanyl]pyridin-3-yl]-thiophen-2-yl-methanone; ethanedioic acid Openeye Name: [2-[6-(dipropylamino)hexylsulfanyl]-3-pyridyl]-(2-thienyl)methanone; oxalic acid CAS Name: [2-[6-(dipropylamino)hexylthio]-3-pyridinyl]-thiophen-2-ylmethanone; oxalic acid IUPAC Name: [2-[6-(dipropylamino)hexylsulfanyl]pyridin-3-yl]-thiophen-2-ylmethanone; oxalic acid Traditional Name: [2-[6-(dipropylamino)hexylthio]-3-pyridyl]-(2-thienyl)methanone; oxalic acid Formula: C24H34N2O5S2 MolecularWeight: 494.66716

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCCCCSC1=C(C=CC=N1)C(=O)C2=CC=CS2.C(=O)(C(=O)O)O

Isomeric SMILES

CCCN(CCC)CCCCCCSC1=C(C=CC=N1)C(=O)C2=CC=CS2.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H32N2OS2.C2H2O4/c1-3-14-24(15-4-2)16-7-5-6-8-17-27-22-19(11-9-13-23-22)21(25)20-12-10-18-26-20;3-1(4)2(5)6/h9-13,18H,3-8,14-17H2,1-2H3;(H,3,4)(H,5,6)