N-(2-diethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-benzamide hydrochloride

Systemtic Name: N-(2-diethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-benzamide hydrochloride Openeye Name: N-(2-diethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-benzamide hydrochloride CAS Name: N-(2-diethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonylbenzamide hydrochloride IUPAC Name: N-(2-diethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonylbenzamide hydrochloride Traditional Name: N-(2-diethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-mesyl-benzamide hydrochloride Formula: C23H30ClN3O3S2 MolecularWeight: 496.0856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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