[4-[(3-methylphenyl)carbonylamino]phenyl] 7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoate

Systemtic Name: [4-[(3-methylphenyl)carbonylamino]phenyl] 7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoate Openeye Name: [4-[(3-methylbenzoyl)amino]phenyl] 7-(5-methyl-2-thienyl)-4,7-dioxo-heptanoate CAS Name: 7-(5-methyl-2-thiophenyl)-4,7-dioxoheptanoic acid [4-[[(3-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(3-methylbenzoyl)amino]phenyl] 7-(5-methylthiophen-2-yl)-4,7-dioxoheptanoate Traditional Name: 4,7-diketo-7-(5-methyl-2-thienyl)enanthic acid [4-(m-toluoylamino)phenyl] ester Formula: C26H25NO5S MolecularWeight: 463.5454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CCC(=O)CCC(=O)C3=CC=C(S3)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CCC(=O)CCC(=O)C3=CC=C(S3)C

InChI

InChI=1S/C26H25NO5S/c1-17-4-3-5-19(16-17)26(31)27-20-7-11-22(12-8-20)32-25(30)15-10-21(28)9-13-23(29)24-14-6-18(2)33-24/h3-8,11-12,14,16H,9-10,13,15H2,1-2H3,(H,27,31)