N-(2-methyl-1,3-benzothiazol-6-yl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-2-(5-pyrrolidinosulfonyl-2-thienyl)acetamide Formula: C18H19N3O3S3 MolecularWeight: 421.55676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C18H19N3O3S3/c1-12-19-15-6-4-13(10-16(15)25-12)20-17(22)11-14-5-7-18(26-14)27(23,24)21-8-2-3-9-21/h4-7,10H,2-3,8-9,11H2,1H3,(H,20,22)