2-methoxyethyl 4-[(3-ethoxyphenyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(3-ethoxyphenyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-[(3-ethoxyphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(3-ethoxyanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[(3-ethoxyphenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-keto-4-(m-phenetylthiocarbamoylamino)butyric acid 2-methoxyethyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C16H22N2O5S/c1-3-22-13-6-4-5-12(11-13)17-16(24)18-14(19)7-8-15(20)23-10-9-21-2/h4-6,11H,3,7-10H2,1-2H3,(H2,17,18,19,24)