3-chloranyl-7-nitro-N-(2-pyrrolidin-1-ylphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-7-nitro-N-(2-pyrrolidin-1-ylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-7-nitro-N-(2-pyrrolidin-1-ylphenyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-7-nitro-N-[2-(1-pyrrolidinyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-7-nitro-N-(2-pyrrolidin-1-ylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-7-nitro-N-(2-pyrrolidinophenyl)benzothiophene-2-carboxamide Formula: C19H16ClN3O3S MolecularWeight: 401.86664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H16ClN3O3S/c20-16-12-6-5-9-15(23(25)26)17(12)27-18(16)19(24)21-13-7-1-2-8-14(13)22-10-3-4-11-22/h1-2,5-9H,3-4,10-11H2,(H,21,24)