ethyl 2-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]-5-bromanyl-4-(phenylazanylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]-5-bromanyl-4-(phenylazanylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-amino-4-oxo-thiazol-5-yl)acetyl]amino]-4-(anilinomethyl)-5-bromo-thiophene-3-carboxylate CAS Name: 2-[[2-(2-amino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]-4-(anilinomethyl)-5-bromo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]-4-(anilinomethyl)-5-bromothiophene-3-carboxylate Traditional Name: 2-[[2-(2-amino-4-keto-2-thiazolin-5-yl)acetyl]amino]-4-(anilinomethyl)-5-bromo-thiophene-3-carboxylic acid ethyl ester Formula: C19H19BrN4O4S2 MolecularWeight: 511.41256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CNC2=CC=CC=C2)Br)NC(=O)CC3C(=O)N=C(S3)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CNC2=CC=CC=C2)Br)NC(=O)CC3C(=O)N=C(S3)N

InChI

InChI=1S/C19H19BrN4O4S2/c1-2-28-18(27)14-11(9-22-10-6-4-3-5-7-10)15(20)30-17(14)23-13(25)8-12-16(26)24-19(21)29-12/h3-7,12,22H,2,8-9H2,1H3,(H,23,25)(H2,21,24,26)