1-(1,3-benzodioxol-5-yl)-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[(4-chlorophenyl)thio]phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[(4-chlorophenyl)thio]phenyl]thiourea Formula: C20H15ClN2O2S2 MolecularWeight: 414.9283

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN2O2S2/c21-13-5-8-15(9-6-13)27-19-4-2-1-3-16(19)23-20(26)22-14-7-10-17-18(11-14)25-12-24-17/h1-11H,12H2,(H2,22,23,26)