ethyl 5-[2-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[[4-(cyclopropylcarbamoyl)-2-quinolyl]sulfanyl]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[[4-[(cyclopropylamino)-oxomethyl]-2-quinolinyl]thio]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylacetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[[4-(cyclopropylcarbamoyl)-2-quinolyl]thio]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C23H23N3O4S2 MolecularWeight: 469.57642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4)C

InChI

InChI=1S/C23H23N3O4S2/c1-3-30-23(29)21-13(2)10-20(32-21)26-18(27)12-31-19-11-16(22(28)24-14-8-9-14)15-6-4-5-7-17(15)25-19/h4-7,10-11,14H,3,8-9,12H2,1-2H3,(H,24,28)(H,26,27)