N-[4-[(2S)-butan-2-yl]phenyl]-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-N-[4-[(1S)-1-methylpropyl]phenyl]acetamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]-N-[4-[(1S)-1-methylpropyl]phenyl]acetamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H27N3O2S/c1-4-18(2)19-9-11-20(12-10-19)27-25(30)17-32-26-28-23-7-5-6-8-24(23)29(26)21-13-15-22(31-3)16-14-21/h5-16,18H,4,17H2,1-3H3,(H,27,30)/t18-/m0/s1