N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(4-methylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NC(C)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)N[C@@H](C)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H20N4O2S/c1-13-7-9-15(10-8-13)27-11-19-23-18(12-28-19)21(26)22-14(2)20-24-16-5-3-4-6-17(16)25-20/h3-10,12,14H,11H2,1-2H3,(H,22,26)(H,24,25)/t14-/m0/s1