N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylthio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanobenzyl)thio]acetamide Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H14N2O3S/c18-8-12-1-3-13(4-2-12)9-23-10-17(20)19-14-5-6-15-16(7-14)22-11-21-15/h1-7H,9-11H2,(H,19,20)