N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H18N4O3S3 MolecularWeight: 470.58762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H18N4O3S3/c26-19(14-7-9-15(10-8-14)31(27,28)25-11-3-4-12-25)24-21-23-17(13-29-21)20-22-16-5-1-2-6-18(16)30-20/h1-2,5-10,13H,3-4,11-12H2,(H,23,24,26)