N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C21H18ClN3O5S2 MolecularWeight: 491.96772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H18ClN3O5S2/c22-16-5-4-14(32(27,28)25-7-1-2-8-25)10-15(16)20(26)24-21-23-17(11-31-21)13-3-6-18-19(9-13)30-12-29-18/h3-6,9-11H,1-2,7-8,12H2,(H,23,24,26)