[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-(3-bromophenyl)prop-2-enoate

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-(3-bromophenyl)prop-2-enoate Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] 3-(3-bromophenyl)prop-2-enoate CAS Name: 3-(3-bromophenyl)-2-propenoic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 3-(3-bromophenyl)prop-2-enoate Traditional Name: 3-(3-bromophenyl)acrylic acid [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl] ester Formula: C16H13BrN2O4S MolecularWeight: 409.25442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C=CC(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C=CC(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C16H13BrN2O4S/c17-11-3-1-2-10(8-11)4-5-14(21)23-9-13(20)19-16-12(15(18)22)6-7-24-16/h1-8H,9H2,(H2,18,22)(H,19,20)