N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(1-methyl-4-pyrazolyl)-4-thiazolecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide Formula: C19H20N6OS2 MolecularWeight: 412.5317

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=CS2)C(=O)N[C@@H](CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H20N6OS2/c1-25-10-12(9-20-25)19-24-16(11-28-19)18(26)23-15(7-8-27-2)17-21-13-5-3-4-6-14(13)22-17/h3-6,9-11,15H,7-8H2,1-2H3,(H,21,22)(H,23,26)/t15-/m0/s1