N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-(1-propan-2-ylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-(1-propan-2-ylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-2-yl]-2-(1-isopropylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-2-pyrrolyl]-2-[(1-propan-2-yl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-(1-propan-2-ylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-2-yl]-2-[(1-isopropylbenzimidazol-2-yl)thio]acetamide Formula: C24H29N5O2S MolecularWeight: 451.58436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3N2C(C)C)CC4CCCO4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3N2C(C)C)C[C@H]4CCCO4)C

InChI

InChI=1S/C24H29N5O2S/c1-15(2)29-21-10-6-5-9-20(21)26-24(29)32-14-22(30)27-23-19(12-25)16(3)17(4)28(23)13-18-8-7-11-31-18/h5-6,9-10,15,18H,7-8,11,13-14H2,1-4H3,(H,27,30)/t18-/m1/s1