N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-methyl-benzothiophene-2-carboxamide CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(imidazol-1-ylmethyl)benzyl]-3-methyl-benzothiophene-2-carboxamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NCC3=CC=CC=C3CN4C=CN=C4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NCC3=CC=CC=C3CN4C=CN=C4

InChI

InChI=1S/C21H19N3OS/c1-15-18-8-4-5-9-19(18)26-20(15)21(25)23-12-16-6-2-3-7-17(16)13-24-11-10-22-14-24/h2-11,14H,12-13H2,1H3,(H,23,25)