4-chloranyl-3-methylsulfonyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 4-chloranyl-3-methylsulfonyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 4-chloro-3-methylsulfonyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide CAS Name: 4-chloro-3-methylsulfonyl-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-chloro-3-methylsulfonyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 4-chloro-3-mesyl-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)benzamide Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4)Cl

InChI

InChI=1S/C19H18ClN3O3S2/c1-28(25,26)17-10-12(4-6-14(17)20)18(24)21-13-5-7-15-16(11-13)27-19(22-15)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,24)