ethyl 2-[2-[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]ethanoylamino]-5-chloranyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]ethanoylamino]-5-chloranyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(N-(3-amino-3-oxo-propyl)-4-methoxy-anilino)acetyl]amino]-5-chloro-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)-1-oxoethyl]amino]-5-chloro-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)acetyl]amino]-5-chloro-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(N-(3-amino-3-keto-propyl)-4-methoxy-anilino)acetyl]amino]-5-chloro-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H26ClN3O5S MolecularWeight: 516.00904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CN(CCC(=O)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CN(CCC(=O)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H26ClN3O5S/c1-3-34-25(32)22-21(16-7-5-4-6-8-16)23(26)35-24(22)28-20(31)15-29(14-13-19(27)30)17-9-11-18(33-2)12-10-17/h4-12H,3,13-15H2,1-2H3,(H2,27,30)(H,28,31)