tert-butyl 2-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: tert-butyl 2-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: tert-butyl 2-[[2-(2-amino-4-oxo-thiazol-5-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-amino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-amino-4-keto-2-thiazolin-5-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid tert-butyl ester Formula: C20H21N3O4S2 MolecularWeight: 431.52844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CC3C(=O)N=C(S3)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CC3C(=O)N=C(S3)N

InChI

InChI=1S/C20H21N3O4S2/c1-20(2,3)27-18(26)12-9-13(11-7-5-4-6-8-11)28-17(12)22-15(24)10-14-16(25)23-19(21)29-14/h4-9,14H,10H2,1-3H3,(H,22,24)(H2,21,23,25)