N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonylpropanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=CC=CC=C2S1)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCN(C1=NC2=CC=CC=C2S1)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O4S2/c1-23(2)13-14-24(21-22-18-6-4-5-7-19(18)29-21)20(25)12-15-30(26,27)17-10-8-16(28-3)9-11-17/h4-11H,12-15H2,1-3H3