1-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-3-(3-chlorophenyl)urea

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-3-(3-chlorophenyl)urea Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-3-(3-chlorophenyl)urea CAS Name: 1-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-3-(3-chlorophenyl)urea IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-3-(3-chlorophenyl)urea Traditional Name: 1-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-3-(3-chlorophenyl)urea Formula: C20H17ClN2O5S2 MolecularWeight: 464.94238

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CNC(=O)NC3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CNC(=O)NC3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H17ClN2O5S2/c21-14-3-1-4-15(10-14)23-20(24)22-11-18(30(25,26)19-5-2-8-29-19)13-6-7-16-17(9-13)28-12-27-16/h1-10,18H,11-12H2,(H2,22,23,24)