5-bromanyl-N-(2-dimethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-(2-dimethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: 5-bromo-N-(2-dimethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 5-bromo-N-(2-dimethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-(2-dimethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: 5-bromo-N-(2-dimethylaminoethyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Formula: C17H18BrN3O3S3 MolecularWeight: 488.44212

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C3=CC=C(S3)Br

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H18BrN3O3S3/c1-20(2)8-9-21(16(22)13-6-7-15(18)25-13)17-19-12-5-4-11(27(3,23)24)10-14(12)26-17/h4-7,10H,8-9H2,1-3H3