methyl 4-[(4,5-dimethoxy-2-methyl-phenyl)carbamothioylamino]butanoate

Systemtic Name: methyl 4-[(4,5-dimethoxy-2-methyl-phenyl)carbamothioylamino]butanoate Openeye Name: methyl 4-[(4,5-dimethoxy-2-methyl-phenyl)carbamothioylamino]butanoate CAS Name: 4-[[(4,5-dimethoxy-2-methylanilino)-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(4,5-dimethoxy-2-methylphenyl)carbamothioylamino]butanoate Traditional Name: 4-[(4,5-dimethoxy-2-methyl-phenyl)thiocarbamoylamino]butyric acid methyl ester Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=S)NCCCC(=O)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=S)NCCCC(=O)OC)OC)OC

InChI

InChI=1S/C15H22N2O4S/c1-10-8-12(19-2)13(20-3)9-11(10)17-15(22)16-7-5-6-14(18)21-4/h8-9H,5-7H2,1-4H3,(H2,16,17,22)