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

Systemtic Name: ethyl 2-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]-5-bromanyl-4-[(cyclopentylamino)methyl]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-amino-4-oxo-thiazol-5-yl)acetyl]amino]-5-bromo-4-[(cyclopentylamino)methyl]thiophene-3-carboxylate CAS Name: 2-[[2-(2-amino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]-5-bromo-4-[(cyclopentylamino)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]-5-bromo-4-[(cyclopentylamino)methyl]thiophene-3-carboxylate Traditional Name: 2-[[2-(2-amino-4-keto-2-thiazolin-5-yl)acetyl]amino]-5-bromo-4-[(cyclopentylamino)methyl]thiophene-3-carboxylic acid ethyl ester Formula: C18H23BrN4O4S2 MolecularWeight: 503.43362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CNC2CCCC2)Br)NC(=O)CC3C(=O)N=C(S3)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CNC2CCCC2)Br)NC(=O)CC3C(=O)N=C(S3)N

InChI

InChI=1S/C18H23BrN4O4S2/c1-2-27-17(26)13-10(8-21-9-5-3-4-6-9)14(19)29-16(13)22-12(24)7-11-15(25)23-18(20)28-11/h9,11,21H,2-8H2,1H3,(H,22,24)(H2,20,23,25)