methyl 2-[[2-(dipropylamino)-4-formamido-6-methylsulfanyl-3-oxidanylidene-hexanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[2-(dipropylamino)-4-formamido-6-methylsulfanyl-3-oxidanylidene-hexanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-(dipropylamino)-4-formamido-6-methylsulfanyl-3-oxo-hexanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-(dipropylamino)-4-formamido-6-(methylthio)-1,3-dioxohexyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-(dipropylamino)-4-formamido-6-methylsulfanyl-3-oxohexanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(dipropylamino)-4-formamido-3-keto-6-(methylthio)hexanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C24H37N3O5S MolecularWeight: 479.63268

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(C(=O)C(CCSC)NC=O)C(=O)NC(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCN(CCC)C(C(=O)C(CCSC)NC=O)C(=O)NC(CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C24H37N3O5S/c1-5-13-27(14-6-2)21(22(29)19(25-17-28)12-15-33-4)23(30)26-20(24(31)32-3)16-18-10-8-7-9-11-18/h7-11,17,19-21H,5-6,12-16H2,1-4H3,(H,25,28)(H,26,30)