3,4-bis(chloranyl)-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,4-bis(chloranyl)-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3,4-dichloro-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3,4-dichloro-N-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,4-dichloro-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3,4-dichloro-N-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]benzothiophene-2-carboxamide Formula: C22H17Cl2N3O3S3 MolecularWeight: 538.48968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=C(C5=C(S4)C=CC=C5Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=C(C5=C(S4)C=CC=C5Cl)Cl

InChI

InChI=1S/C22H17Cl2N3O3S3/c23-15-4-3-5-17-18(15)19(24)20(32-17)21(28)26-22-25-16(12-31-22)13-6-8-14(9-7-13)33(29,30)27-10-1-2-11-27/h3-9,12H,1-2,10-11H2,(H,25,26,28)