4-[2-[1,3-benzoxazol-2-yl(methyl)amino]ethylsulfanyl]benzaldehyde

Systemtic Name: 4-[2-[1,3-benzoxazol-2-yl(methyl)amino]ethylsulfanyl]benzaldehyde Openeye Name: 4-[2-[1,3-benzoxazol-2-yl(methyl)amino]ethylsulfanyl]benzaldehyde CAS Name: 4-[2-[1,3-benzoxazol-2-yl(methyl)amino]ethylthio]benzaldehyde IUPAC Name: 4-[2-[1,3-benzoxazol-2-yl(methyl)amino]ethylsulfanyl]benzaldehyde Traditional Name: 4-[2-[1,3-benzoxazol-2-yl(methyl)amino]ethylthio]benzaldehyde Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCSC1=CC=C(C=C1)C=O)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CN(CCSC1=CC=C(C=C1)C=O)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C17H16N2O2S/c1-19(17-18-15-4-2-3-5-16(15)21-17)10-11-22-14-8-6-13(12-20)7-9-14/h2-9,12H,10-11H2,1H3