N-[(4-chlorophenyl)methyl]-1,3-benzodioxole-5-carbothioamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1,3-benzodioxole-5-carbothioamide Openeye Name: N-[(4-chlorophenyl)methyl]-1,3-benzodioxole-5-carbothioamide CAS Name: N-[(4-chlorophenyl)methyl]-1,3-benzodioxole-5-carbothioamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1,3-benzodioxole-5-carbothioamide Traditional Name: N-(4-chlorobenzyl)-1,3-benzodioxole-5-carbothioamide Formula: C15H12ClNO2S MolecularWeight: 305.77928

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=S)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=S)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClNO2S/c16-12-4-1-10(2-5-12)8-17-15(20)11-3-6-13-14(7-11)19-9-18-13/h1-7H,8-9H2,(H,17,20)