N-(2-diethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-benzamide CAS Name: N-(2-diethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-methylsulfonylbenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-methylsulfonylbenzamide Traditional Name: N-(2-diethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-mesyl-benzamide Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCN(CC)CC)C(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCN(CC)CC)C(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H29N3O3S2/c1-5-17-11-12-20-21(15-17)30-23(24-20)26(14-13-25(6-2)7-3)22(27)18-9-8-10-19(16-18)31(4,28)29/h8-12,15-16H,5-7,13-14H2,1-4H3