N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-3-nitro-4-pyrrolidino-benzamide Formula: C18H15FN4O3S MolecularWeight: 386.400103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN4O3S/c19-12-4-5-13-16(10-12)27-18(20-13)21-17(24)11-3-6-14(15(9-11)23(25)26)22-7-1-2-8-22/h3-6,9-10H,1-2,7-8H2,(H,20,21,24)