N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)propanamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-besyl-N-(2-diethylaminoethyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)propionamide Formula: C23H29N3O5S3 MolecularWeight: 523.68846

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O5S3/c1-4-25(5-2)14-15-26(22(27)13-16-34(30,31)18-9-7-6-8-10-18)23-24-20-12-11-19(33(3,28)29)17-21(20)32-23/h6-12,17H,4-5,13-16H2,1-3H3