butyl 2-[(4Z)-1-(3-chloranyl-4-methoxy-phenyl)-5-oxidanylidene-4-(thiophen-2-ylmethylidene)imidazol-2-yl]sulfanylethanoate

Systemtic Name: butyl 2-[(4Z)-1-(3-chloranyl-4-methoxy-phenyl)-5-oxidanylidene-4-(thiophen-2-ylmethylidene)imidazol-2-yl]sulfanylethanoate Openeye Name: butyl 2-[(4Z)-1-(3-chloro-4-methoxy-phenyl)-5-oxo-4-(2-thienylmethylene)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[(4Z)-1-(3-chloro-4-methoxyphenyl)-5-oxo-4-(thiophen-2-ylmethylidene)-2-imidazolyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[(4Z)-1-(3-chloro-4-methoxyphenyl)-5-oxo-4-(thiophen-2-ylmethylidene)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[(4Z)-1-(3-chloro-4-methoxy-phenyl)-5-keto-4-(2-thenylidene)-2-imidazolin-2-yl]thio]acetic acid butyl ester Formula: C21H21ClN2O4S2 MolecularWeight: 464.98544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC(=CC2=CC=CS2)C(=O)N1C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCCCOC(=O)CSC1=N/C(=C\C2=CC=CS2)/C(=O)N1C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H21ClN2O4S2/c1-3-4-9-28-19(25)13-30-21-23-17(12-15-6-5-10-29-15)20(26)24(21)14-7-8-18(27-2)16(22)11-14/h5-8,10-12H,3-4,9,13H2,1-2H3/b17-12-