N-[1-[1-[4-(4-butan-2-ylphenoxy)butyl]benzimidazol-2-yl]ethyl]-2-methyl-prop-2-enamide

Systemtic Name: N-[1-[1-[4-(4-butan-2-ylphenoxy)butyl]benzimidazol-2-yl]ethyl]-2-methyl-prop-2-enamide Openeye Name: 2-methyl-N-[1-[1-[4-(4-sec-butylphenoxy)butyl]benzimidazol-2-yl]ethyl]prop-2-enamide CAS Name: N-[1-[1-[4-(4-butan-2-ylphenoxy)butyl]-2-benzimidazolyl]ethyl]-2-methyl-2-propenamide IUPAC Name: N-[1-[1-[4-(4-butan-2-ylphenoxy)butyl]benzimidazol-2-yl]ethyl]-2-methylprop-2-enamide Traditional Name: 2-methyl-N-[1-[1-[4-(4-sec-butylphenoxy)butyl]benzimidazol-2-yl]ethyl]acrylamide Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCCCCN2C3=CC=CC=C3N=C2C(C)NC(=O)C(=C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCCCCN2C3=CC=CC=C3N=C2C(C)NC(=O)C(=C)C

InChI

InChI=1S/C27H35N3O2/c1-6-20(4)22-13-15-23(16-14-22)32-18-10-9-17-30-25-12-8-7-11-24(25)29-26(30)21(5)28-27(31)19(2)3/h7-8,11-16,20-21H,2,6,9-10,17-18H2,1,3-5H3,(H,28,31)