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

Systemtic Name: 2-chloranyl-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-benzylthiazol-2-yl)-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[5-(phenylmethyl)-2-thiazolyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-benzylthiazol-2-yl)-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C21H20ClN3O3S2 MolecularWeight: 461.9848

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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=C(S3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C21H20ClN3O3S2/c22-19-9-8-17(30(27,28)25-10-4-5-11-25)13-18(19)20(26)24-21-23-14-16(29-21)12-15-6-2-1-3-7-15/h1-3,6-9,13-14H,4-5,10-12H2,(H,23,24,26)