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

Systemtic Name: N-(2-diethylaminoethyl)-3-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-diethylaminoethyl)-3-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-3-(ethylthio)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-diethylaminoethyl)-3-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-diethylaminoethyl)-3-(ethylthio)-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C23H29N3O3S3 MolecularWeight: 491.68966

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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)C3=CC(=CC=C3)SCC

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S3/c1-5-25(6-2)13-14-26(22(27)17-9-8-10-18(15-17)30-7-3)23-24-20-12-11-19(32(4,28)29)16-21(20)31-23/h8-12,15-16H,5-7,13-14H2,1-4H3