1,3-benzodioxol-5-ylmethyl N-(4-phenyldiazenylphenyl)carbamodithioate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl N-(4-phenyldiazenylphenyl)carbamodithioate Openeye Name: 1,3-benzodioxol-5-ylmethyl N-(4-phenylazophenyl)carbamodithioate CAS Name: N-(4-phenyldiazenylphenyl)carbamodithioic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl N-(4-phenyldiazenylphenyl)carbamodithioate Traditional Name: N-(4-phenylazophenyl)carbamodithioic acid piperonyl ester Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC(=S)NC3=CC=C(C=C3)N=NC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC(=S)NC3=CC=C(C=C3)N=NC4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S2/c27-21(28-13-15-6-11-19-20(12-15)26-14-25-19)22-16-7-9-18(10-8-16)24-23-17-4-2-1-3-5-17/h1-12H,13-14H2,(H,22,27)