methyl 5-[[3-(dimethylamino)propylcarbamothioylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[3-(dimethylamino)propylcarbamothioylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[3-(dimethylamino)propylcarbamothioylamino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[[3-(dimethylamino)propylamino]-sulfanylidenemethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[3-(dimethylamino)propylcarbamothioylamino]methyl]-2-methoxybenzoate Traditional Name: 5-[[3-(dimethylamino)propylthiocarbamoylamino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)NCC1=CC(=C(C=C1)OC)C(=O)OC

Isomeric SMILES

CN(C)CCCNC(=S)NCC1=CC(=C(C=C1)OC)C(=O)OC

InChI

InChI=1S/C16H25N3O3S/c1-19(2)9-5-8-17-16(23)18-11-12-6-7-14(21-3)13(10-12)15(20)22-4/h6-7,10H,5,8-9,11H2,1-4H3,(H2,17,18,23)