N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-mesyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide Formula: C22H24N4O3S3 MolecularWeight: 488.64596

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C22H24N4O3S3/c1-4-25(5-2)11-12-26(21(27)15-9-10-16-18(13-15)30-14-23-16)22-24-20-17(31-22)7-6-8-19(20)32(3,28)29/h6-10,13-14H,4-5,11-12H2,1-3H3