ethyl 2-[[4-oxidanylidene-4-(1,3-thiazol-2-ylamino)butanoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-oxidanylidene-4-(1,3-thiazol-2-ylamino)butanoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-oxo-4-(thiazol-2-ylamino)butanoyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[1,4-dioxo-4-(2-thiazolylamino)butyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-oxo-4-(1,3-thiazol-2-ylamino)butanoyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[4-keto-4-(thiazol-2-ylamino)butanoyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCC(=O)NC3=NC=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCC(=O)NC3=NC=CS3

InChI

InChI=1S/C20H19N3O4S2/c1-2-27-19(26)17-14(13-6-4-3-5-7-13)12-29-18(17)22-15(24)8-9-16(25)23-20-21-10-11-28-20/h3-7,10-12H,2,8-9H2,1H3,(H,22,24)(H,21,23,25)