[2-oxidanylidene-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl] 4-(acetamidomethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl] 4-(acetamidomethyl)benzoate Openeye Name: [2-[allyl(2-thienylmethyl)amino]-2-oxo-ethyl] 4-(acetamidomethyl)benzoate CAS Name: 4-(acetamidomethyl)benzoic acid [2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl] 4-(acetamidomethyl)benzoate Traditional Name: 4-(acetamidomethyl)benzoic acid [2-[allyl(2-thenyl)amino]-2-keto-ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)OCC(=O)N(CC=C)CC2=CC=CS2

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)OCC(=O)N(CC=C)CC2=CC=CS2

InChI

InChI=1S/C20H22N2O4S/c1-3-10-22(13-18-5-4-11-27-18)19(24)14-26-20(25)17-8-6-16(7-9-17)12-21-15(2)23/h3-9,11H,1,10,12-14H2,2H3,(H,21,23)