ethyl 2-[2-[[5-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[[5-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[5-(2-amino-2-oxo-ethyl)-4-methyl-thiazol-2-yl]sulfanylacetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[[5-(2-amino-2-oxoethyl)-4-methyl-2-thiazolyl]thio]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[[5-(2-amino-2-oxoethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[[5-(2-amino-2-keto-ethyl)-4-methyl-thiazol-2-yl]thio]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O4S3 MolecularWeight: 475.60414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC(=C(S3)CC(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC(=C(S3)CC(=O)N)C

InChI

InChI=1S/C21H21N3O4S3/c1-3-28-20(27)18-14(13-7-5-4-6-8-13)10-29-19(18)24-17(26)11-30-21-23-12(2)15(31-21)9-16(22)25/h4-8,10H,3,9,11H2,1-2H3,(H2,22,25)(H,24,26)