ethyl 2-[[2-(2-bromophenyl)sulfanyl-3-(4-methoxyphenyl)propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[[2-(2-bromophenyl)sulfanyl-3-(4-methoxyphenyl)propanoyl]amino]-4-methyl-pentanoate Openeye Name: ethyl 2-[[2-(2-bromophenyl)sulfanyl-3-(4-methoxyphenyl)propanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-bromophenyl)thio]-3-(4-methoxyphenyl)-1-oxopropyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-bromophenyl)sulfanyl-3-(4-methoxyphenyl)propanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-bromophenyl)thio]-3-(4-methoxyphenyl)propanoyl]amino]-4-methyl-valeric acid ethyl ester Formula: C24H30BrNO4S MolecularWeight: 508.4683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)C(CC1=CC=C(C=C1)OC)SC2=CC=CC=C2Br

Isomeric SMILES

CCOC(=O)C(CC(C)C)NC(=O)C(CC1=CC=C(C=C1)OC)SC2=CC=CC=C2Br

InChI

InChI=1S/C24H30BrNO4S/c1-5-30-24(28)20(14-16(2)3)26-23(27)22(31-21-9-7-6-8-19(21)25)15-17-10-12-18(29-4)13-11-17/h6-13,16,20,22H,5,14-15H2,1-4H3,(H,26,27)