N-[(1-butylbenzimidazol-2-yl)methyl]-3-chloranyl-N-(3-methylbutyl)thiophene-2-carboxamide

Systemtic Name: N-[(1-butylbenzimidazol-2-yl)methyl]-3-chloranyl-N-(3-methylbutyl)thiophene-2-carboxamide Openeye Name: N-[(1-butylbenzimidazol-2-yl)methyl]-3-chloro-N-isopentyl-thiophene-2-carboxamide CAS Name: N-[(1-butyl-2-benzimidazolyl)methyl]-3-chloro-N-(3-methylbutyl)-2-thiophenecarboxamide IUPAC Name: N-[(1-butylbenzimidazol-2-yl)methyl]-3-chloro-N-(3-methylbutyl)thiophene-2-carboxamide Traditional Name: N-[(1-butylbenzimidazol-2-yl)methyl]-3-chloro-N-isoamyl-thiophene-2-carboxamide Formula: C22H28ClN3OS MolecularWeight: 417.99522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C1CN(CCC(C)C)C(=O)C3=C(C=CS3)Cl

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C1CN(CCC(C)C)C(=O)C3=C(C=CS3)Cl

InChI

InChI=1S/C22H28ClN3OS/c1-4-5-12-26-19-9-7-6-8-18(19)24-20(26)15-25(13-10-16(2)3)22(27)21-17(23)11-14-28-21/h6-9,11,14,16H,4-5,10,12-13,15H2,1-3H3