2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-methoxy-4-propoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-methoxy-4-propoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-methoxy-4-propoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(E)-(3-methoxy-4-propoxy-benzylidene)amino]acetamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3O2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3O2)OC

InChI

InChI=1S/C20H21N3O4S/c1-3-10-26-17-9-8-14(11-18(17)25-2)12-21-23-19(24)13-28-20-22-15-6-4-5-7-16(15)27-20/h4-9,11-12H,3,10,13H2,1-2H3,(H,23,24)/b21-12+