ethyl 3,4-dimethyl-2-[(E)-3-(5-nitrothiophen-2-yl)prop-2-enoyl]imino-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 3,4-dimethyl-2-[(E)-3-(5-nitrothiophen-2-yl)prop-2-enoyl]imino-1,3-thiazole-5-carboxylate Openeye Name: ethyl 3,4-dimethyl-2-[(E)-3-(5-nitro-2-thienyl)prop-2-enoyl]imino-thiazole-5-carboxylate CAS Name: 3,4-dimethyl-2-[(E)-3-(5-nitro-2-thiophenyl)-1-oxoprop-2-enyl]imino-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3,4-dimethyl-2-[(E)-3-(5-nitrothiophen-2-yl)prop-2-enoyl]imino-1,3-thiazole-5-carboxylate Traditional Name: 3,4-dimethyl-2-[(E)-3-(5-nitro-2-thienyl)acryloyl]imino-4-thiazoline-5-carboxylic acid ethyl ester Formula: C15H15N3O5S2 MolecularWeight: 381.4267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC(=O)C=CC2=CC=C(S2)[N+](=O)[O-])S1)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=NC(=O)/C=C/C2=CC=C(S2)[N+](=O)[O-])S1)C)C

InChI

InChI=1S/C15H15N3O5S2/c1-4-23-14(20)13-9(2)17(3)15(25-13)16-11(19)7-5-10-6-8-12(24-10)18(21)22/h5-8H,4H2,1-3H3/b7-5+,16-15?