[3-[(4-chloranyl-2-methyl-phenyl)amino]-5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl] ethanoate

Systemtic Name: [3-[(4-chloranyl-2-methyl-phenyl)amino]-5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl] ethanoate Openeye Name: [3-(4-chloro-2-methyl-anilino)-5-(2-furylmethylsulfanylmethyl)-2-furyl] acetate CAS Name: acetic acid [3-(4-chloro-2-methylanilino)-5-[(2-furanylmethylthio)methyl]-2-furanyl] ester IUPAC Name: [3-(4-chloro-2-methylanilino)-5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl] acetate Traditional Name: acetic acid [3-(4-chloro-2-methyl-anilino)-5-[(2-furfurylthio)methyl]-2-furyl] ester Formula: C19H18ClNO4S MolecularWeight: 391.86852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC2=C(OC(=C2)CSCC3=CC=CO3)OC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC2=C(OC(=C2)CSCC3=CC=CO3)OC(=O)C

InChI

InChI=1S/C19H18ClNO4S/c1-12-8-14(20)5-6-17(12)21-18-9-16(25-19(18)24-13(2)22)11-26-10-15-4-3-7-23-15/h3-9,21H,10-11H2,1-2H3