3-chloranyl-N-(4-imidazol-1-ylbutyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(4-imidazol-1-ylbutyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(4-imidazol-1-ylbutyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(1-imidazolyl)butyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4-imidazol-1-ylbutyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4-imidazol-1-ylbutyl)benzothiophene-2-carboxamide Formula: C16H16ClN3OS MolecularWeight: 333.83574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCCCCN3C=CN=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCCCCN3C=CN=C3)Cl

InChI

InChI=1S/C16H16ClN3OS/c17-14-12-5-1-2-6-13(12)22-15(14)16(21)19-7-3-4-9-20-10-8-18-11-20/h1-2,5-6,8,10-11H,3-4,7,9H2,(H,19,21)