3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[4-methoxy-3-(4-pyridylmethoxy)phenyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[4-methoxy-3-(4-pyridylmethoxy)phenyl]propionamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCSCC(=O)N)OCC2=CC=NC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCSCC(=O)N)OCC2=CC=NC=C2

InChI

InChI=1S/C18H21N3O4S/c1-24-15-3-2-14(21-18(23)6-9-26-12-17(19)22)10-16(15)25-11-13-4-7-20-8-5-13/h2-5,7-8,10H,6,9,11-12H2,1H3,(H2,19,22)(H,21,23)