5-[[4-(2,4-dimethylphenyl)-3-propan-2-yloxycarbonyl-thiophen-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[4-(2,4-dimethylphenyl)-3-propan-2-yloxycarbonyl-thiophen-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[4-(2,4-dimethylphenyl)-3-isopropoxycarbonyl-2-thienyl]amino]-5-oxo-pentanoate CAS Name: 5-[[4-(2,4-dimethylphenyl)-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-5-oxopentanoate IUPAC Name: 5-[[4-(2,4-dimethylphenyl)-3-propan-2-yloxycarbonylthiophen-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[4-(2,4-dimethylphenyl)-3-isopropoxycarbonyl-2-thienyl]amino]-5-keto-valerate Formula: C21H24NO5S- MolecularWeight: 402.48396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)CCCC(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)CCCC(=O)[O-])C

InChI

InChI=1S/C21H25NO5S/c1-12(2)27-21(26)19-16(15-9-8-13(3)10-14(15)4)11-28-20(19)22-17(23)6-5-7-18(24)25/h8-12H,5-7H2,1-4H3,(H,22,23)(H,24,25)/p-1