1-[2-(3,4-dimethylphenoxy)propanoyl]-N-(1,3-thiazol-2-yl)indole-5-sulfonamide

Systemtic Name: 1-[2-(3,4-dimethylphenoxy)propanoyl]-N-(1,3-thiazol-2-yl)indole-5-sulfonamide Openeye Name: 1-[2-(3,4-dimethylphenoxy)propanoyl]-N-thiazol-2-yl-indole-5-sulfonamide CAS Name: 1-[2-(3,4-dimethylphenoxy)-1-oxopropyl]-N-(2-thiazolyl)-5-indolesulfonamide IUPAC Name: 1-[2-(3,4-dimethylphenoxy)propanoyl]-N-(1,3-thiazol-2-yl)indole-5-sulfonamide Traditional Name: 1-[2-(3,4-dimethylphenoxy)propanoyl]-N-thiazol-2-yl-indole-5-sulfonamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(C)C(=O)N2C=CC3=C2C=CC(=C3)S(=O)(=O)NC4=NC=CS4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(C)C(=O)N2C=CC3=C2C=CC(=C3)S(=O)(=O)NC4=NC=CS4)C

InChI

InChI=1S/C22H21N3O4S2/c1-14-4-5-18(12-15(14)2)29-16(3)21(26)25-10-8-17-13-19(6-7-20(17)25)31(27,28)24-22-23-9-11-30-22/h4-13,16H,1-3H3,(H,23,24)