methyl 2-[2-[(E)-1-azanyl-2-[2-(2-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-2-(dimethylamino)ethenyl]phenyl]ethanoate

Systemtic Name: methyl 2-[2-[(E)-1-azanyl-2-[2-(2-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-2-(dimethylamino)ethenyl]phenyl]ethanoate Openeye Name: methyl 2-[2-[(E)-1-amino-2-[2-(2-chlorophenyl)-2-oxo-ethyl]sulfanyl-2-(dimethylamino)vinyl]phenyl]acetate CAS Name: 2-[2-[(E)-1-amino-2-[[2-(2-chlorophenyl)-2-oxoethyl]thio]-2-(dimethylamino)ethenyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(E)-1-amino-2-[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl-2-(dimethylamino)ethenyl]phenyl]acetate Traditional Name: 2-[2-[(E)-1-amino-2-[[2-(2-chlorophenyl)-2-keto-ethyl]thio]-2-(dimethylamino)vinyl]phenyl]acetic acid methyl ester Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=C(C1=CC=CC=C1CC(=O)OC)N)SCC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CN(C)/C(=C(/C1=CC=CC=C1CC(=O)OC)\N)/SCC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C21H23ClN2O3S/c1-24(2)21(28-13-18(25)16-10-6-7-11-17(16)22)20(23)15-9-5-4-8-14(15)12-19(26)27-3/h4-11H,12-13,23H2,1-3H3/b21-20+