ethyl 2-[[cyclopropyl-[3-(4-nitrophenyl)prop-2-enoyl]amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[cyclopropyl-[3-(4-nitrophenyl)prop-2-enoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[cyclopropyl-[3-(4-nitrophenyl)prop-2-enoyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclopropyl-[3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclopropyl-[3-(4-nitrophenyl)prop-2-enoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclopropyl-[3-(4-nitrophenyl)acryloyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C2CC2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C2CC2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5S/c1-2-27-19(24)16-12-28-17(20-16)11-21(14-8-9-14)18(23)10-5-13-3-6-15(7-4-13)22(25)26/h3-7,10,12,14H,2,8-9,11H2,1H3