methyl 2-[[4-[(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]phenyl]carbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-[(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]phenyl]carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[4-[(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]phenyl]carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[4-[(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]anilino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]phenyl]carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[4-[(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]phenyl]thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C24H24FN3O4S3 MolecularWeight: 533.658463

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=C(C=C(S4)C)C(=O)OC)C=CC(=C2)F

Isomeric SMILES

CC1CCC2=C(N1S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=C(C=C(S4)C)C(=O)OC)C=CC(=C2)F

InChI

InChI=1S/C24H24FN3O4S3/c1-14-4-5-16-13-17(25)6-11-21(16)28(14)35(30,31)19-9-7-18(8-10-19)26-24(33)27-22-20(23(29)32-3)12-15(2)34-22/h6-14H,4-5H2,1-3H3,(H2,26,27,33)