N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C20H21N3O4S2/c1-13-5-7-15(29(25,26)23-9-3-4-10-23)12-16(13)19(24)22-20-21-17-8-6-14(27-2)11-18(17)28-20/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,22,24)