[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-oxo-ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-[[4-(4-nitrophenyl)-2-thiazolyl]-prop-2-enylamino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enylamino]-2-oxoethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)COC(=O)C3=CC=CN3

Isomeric SMILES

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)COC(=O)C3=CC=CN3

InChI

InChI=1S/C19H16N4O5S/c1-2-10-22(17(24)11-28-18(25)15-4-3-9-20-15)19-21-16(12-29-19)13-5-7-14(8-6-13)23(26)27/h2-9,12,20H,1,10-11H2