methyl 6-[(4-ethoxy-3-methoxy-phenyl)carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[(4-ethoxy-3-methoxy-phenyl)carbamothioylamino]hexanoate Openeye Name: methyl 6-[(4-ethoxy-3-methoxy-phenyl)carbamothioylamino]hexanoate CAS Name: 6-[[(4-ethoxy-3-methoxyanilino)-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-ethoxy-3-methoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 6-[(4-ethoxy-3-methoxy-phenyl)thiocarbamoylamino]hexanoic acid methyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=S)NCCCCCC(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=S)NCCCCCC(=O)OC)OC

InChI

InChI=1S/C17H26N2O4S/c1-4-23-14-10-9-13(12-15(14)21-2)19-17(24)18-11-7-5-6-8-16(20)22-3/h9-10,12H,4-8,11H2,1-3H3,(H2,18,19,24)