N-(1,3-benzothiazol-6-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-6-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-6-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-6-yl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-6-yl)-4-pyrrolidinosulfonyl-benzamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C18H17N3O3S2/c22-18(20-14-5-8-16-17(11-14)25-12-19-16)13-3-6-15(7-4-13)26(23,24)21-9-1-2-10-21/h3-8,11-12H,1-2,9-10H2,(H,20,22)