S-[2-[6-[[2-[3-(dimethylamino)propyl-methyl-amino]quinolin-6-yl]sulfonylamino]pyridin-3-yl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[6-[[2-[3-(dimethylamino)propyl-methyl-amino]quinolin-6-yl]sulfonylamino]pyridin-3-yl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[6-[[2-[3-(dimethylamino)propyl-methyl-amino]-6-quinolyl]sulfonylamino]-3-pyridyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[6-[[2-[3-(dimethylamino)propyl-methylamino]-6-quinolinyl]sulfonylamino]-3-pyridinyl]-2-oxoethyl] ester IUPAC Name: S-[2-[6-[[2-[3-(dimethylamino)propyl-methylamino]quinolin-6-yl]sulfonylamino]pyridin-3-yl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[6-[[2-[3-(dimethylamino)propyl-methyl-amino]-6-quinolyl]sulfonylamino]-3-pyridyl]-2-keto-ethyl] ester Formula: C24H29N5O4S2 MolecularWeight: 515.64816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CN=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)N(C)CCCN(C)C

Isomeric SMILES

CC(=O)SCC(=O)C1=CN=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)N(C)CCCN(C)C

InChI

InChI=1S/C24H29N5O4S2/c1-17(30)34-16-22(31)19-6-10-23(25-15-19)27-35(32,33)20-8-9-21-18(14-20)7-11-24(26-21)29(4)13-5-12-28(2)3/h6-11,14-15H,5,12-13,16H2,1-4H3,(H,25,27)