N-[2-[2-(4-butylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethyl]-2-imidazol-1-yl-ethanamide

Systemtic Name: N-[2-[2-(4-butylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethyl]-2-imidazol-1-yl-ethanamide Openeye Name: N-[2-[2-(4-butylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethyl]-2-imidazol-1-yl-acetamide CAS Name: N-[2-[2-(4-butylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethyl]-2-(1-imidazolyl)acetamide IUPAC Name: N-[2-[2-(4-butylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethyl]-2-imidazol-1-ylacetamide Traditional Name: N-[2-[2-(4-butylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethyl]-2-imidazol-1-yl-acetamide Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2CCNC(=O)CN4C=CN=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2CCNC(=O)CN4C=CN=C4

InChI

InChI=1S/C26H32N4O3S/c1-2-3-6-21-9-11-23(12-10-21)34(32,33)30-17-14-22-7-4-5-8-24(22)25(30)13-15-28-26(31)19-29-18-16-27-20-29/h4-5,7-12,16,18,20,25H,2-3,6,13-15,17,19H2,1H3,(H,28,31)