2-methoxyethyl 6-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-methoxyethyl 6-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-methoxyethyl 6-[2-(4-bromoanilino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(2-furyl)-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[[2-(4-bromoanilino)-2-oxoethyl]thio]-5-cyano-4-(2-furanyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 6-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[[2-(4-bromoanilino)-2-keto-ethyl]thio]-5-cyano-4-(2-furyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid 2-methoxyethyl ester Formula: C23H22BrN3O5S MolecularWeight: 532.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)Br)C#N)C3=CC=CO3)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)Br)C#N)C3=CC=CO3)C(=O)OCCOC

InChI

InChI=1S/C23H22BrN3O5S/c1-14-20(23(29)32-11-10-30-2)21(18-4-3-9-31-18)17(12-25)22(26-14)33-13-19(28)27-16-7-5-15(24)6-8-16/h3-9,21,26H,10-11,13H2,1-2H3,(H,27,28)