2-(6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-ylmethyl)benzenecarbothioamide

Systemtic Name: 2-(6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-ylmethyl)benzenecarbothioamide Openeye Name: 2-(6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-ylmethyl)benzenecarbothioamide CAS Name: 2-(6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-ylmethyl)benzenecarbothioamide IUPAC Name: 2-(6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-ylmethyl)benzenecarbothioamide Traditional Name: 2-(6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-ylmethyl)thiobenzamide Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C3C(=C2)N(C=N3)CC4=CC=CC=C4C(=S)N

Isomeric SMILES

C1COC2=C(O1)C=C3C(=C2)N(C=N3)CC4=CC=CC=C4C(=S)N

InChI

InChI=1S/C17H15N3O2S/c18-17(23)12-4-2-1-3-11(12)9-20-10-19-13-7-15-16(8-14(13)20)22-6-5-21-15/h1-4,7-8,10H,5-6,9H2,(H2,18,23)