2-chloranyl-N-[[4-[3-(decylcarbamoyl)phenyl]sulfanylphenyl]carbamoyl]-3,4-dimethoxy-benzamide

Systemtic Name: 2-chloranyl-N-[[4-[3-(decylcarbamoyl)phenyl]sulfanylphenyl]carbamoyl]-3,4-dimethoxy-benzamide Openeye Name: 2-chloro-N-[[4-[3-(decylcarbamoyl)phenyl]sulfanylphenyl]carbamoyl]-3,4-dimethoxy-benzamide CAS Name: 2-chloro-N-[[4-[[3-[(decylamino)-oxomethyl]phenyl]thio]anilino]-oxomethyl]-3,4-dimethoxybenzamide IUPAC Name: 2-chloro-N-[[4-[3-(decylcarbamoyl)phenyl]sulfanylphenyl]carbamoyl]-3,4-dimethoxybenzamide Traditional Name: 2-chloro-N-[[4-[[3-(decylcarbamoyl)phenyl]thio]phenyl]carbamoyl]-3,4-dimethoxy-benzamide Formula: C33H40ClN3O5S MolecularWeight: 626.2058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=O)C1=CC(=CC=C1)SC2=CC=C(C=C2)NC(=O)NC(=O)C3=C(C(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CCCCCCCCCCNC(=O)C1=CC(=CC=C1)SC2=CC=C(C=C2)NC(=O)NC(=O)C3=C(C(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C33H40ClN3O5S/c1-4-5-6-7-8-9-10-11-21-35-31(38)23-13-12-14-26(22-23)43-25-17-15-24(16-18-25)36-33(40)37-32(39)27-19-20-28(41-2)30(42-3)29(27)34/h12-20,22H,4-11,21H2,1-3H3,(H,35,38)(H2,36,37,39,40)