N-(4-chloranyl-1,3-benzothiazol-7-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-7-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-7-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-7-yl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-7-yl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-7-yl)-4-pyrrolidinosulfonyl-benzamide Formula: C18H16ClN3O3S2 MolecularWeight: 421.92094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4C(=C(C=C3)Cl)N=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4C(=C(C=C3)Cl)N=CS4

InChI

InChI=1S/C18H16ClN3O3S2/c19-14-7-8-15(17-16(14)20-11-26-17)21-18(23)12-3-5-13(6-4-12)27(24,25)22-9-1-2-10-22/h3-8,11H,1-2,9-10H2,(H,21,23)