ethyl 4-methyl-2-[3-(3-nitrophenyl)prop-2-enoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-(3-nitrophenyl)prop-2-enoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(3-nitrophenyl)prop-2-enoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-(3-nitrophenyl)prop-2-enoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[3-(3-nitrophenyl)acryloyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C16H15N3O5S MolecularWeight: 361.3724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H15N3O5S/c1-3-24-15(21)14-10(2)17-16(25-14)18-13(20)8-7-11-5-4-6-12(9-11)19(22)23/h4-9H,3H2,1-2H3,(H,17,18,20)