3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]propionamide Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CCSCC(=O)N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CCSCC(=O)N)OCC

InChI

InChI=1S/C17H26N2O4S/c1-3-22-14-6-5-13(11-15(14)23-4-2)7-9-19-17(21)8-10-24-12-16(18)20/h5-6,11H,3-4,7-10,12H2,1-2H3,(H2,18,20)(H,19,21)