ethyl 3-[[2-[3-methylbutyl-[2-[[4-[(2-methylphenyl)carbamoylamino]phenyl]amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]amino]propanoate

Systemtic Name: ethyl 3-[[2-[3-methylbutyl-[2-[[4-[(2-methylphenyl)carbamoylamino]phenyl]amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]amino]propanoate Openeye Name: ethyl 3-[[2-[isopentyl-[2-[4-(o-tolylcarbamoylamino)anilino]-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]propanoate CAS Name: 3-[[2-[[2-[4-[[(2-methylanilino)-oxomethyl]amino]anilino]-2-oxoethyl]-(3-methylbutyl)amino]-2-oxoethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[3-methylbutyl-[2-[4-[(2-methylphenyl)carbamoylamino]anilino]-2-oxoethyl]amino]-2-oxoethyl]amino]propanoate Traditional Name: 3-[[2-[isoamyl-[2-keto-2-[4-(o-tolylcarbamoylamino)anilino]ethyl]amino]-2-keto-ethyl]amino]propionic acid ethyl ester Formula: C28H39N5O5 MolecularWeight: 525.63976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNCC(=O)N(CCC(C)C)CC(=O)NC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)CCNCC(=O)N(CCC(C)C)CC(=O)NC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C28H39N5O5/c1-5-38-27(36)14-16-29-18-26(35)33(17-15-20(2)3)19-25(34)30-22-10-12-23(13-11-22)31-28(37)32-24-9-7-6-8-21(24)4/h6-13,20,29H,5,14-19H2,1-4H3,(H,30,34)(H2,31,32,37)