N-tert-butyl-2-[[1-[(3-methylimidazol-4-yl)methyl]-6-phenyl-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]ethanamide

Systemtic Name: N-tert-butyl-2-[[1-[(3-methylimidazol-4-yl)methyl]-6-phenyl-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]ethanamide Openeye Name: N-tert-butyl-2-[[1-[(3-methylimidazol-4-yl)methyl]-6-phenyl-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]acetamide CAS Name: N-tert-butyl-2-[[1-[(3-methyl-4-imidazolyl)methyl]-6-phenyl-3,4-dihydro-2H-quinolin-3-yl]-[(1-methyl-4-imidazolyl)sulfonyl]amino]acetamide IUPAC Name: N-tert-butyl-2-[[1-[(3-methylimidazol-4-yl)methyl]-6-phenyl-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonylamino]acetamide Traditional Name: N-tert-butyl-2-[[1-[(3-methylimidazol-4-yl)methyl]-6-phenyl-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]acetamide Formula: C30H37N7O3S MolecularWeight: 575.72488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C1CC2=C(C=CC(=C2)C3=CC=CC=C3)N(C1)CC4=CN=CN4C)S(=O)(=O)C5=CN(C=N5)C

Isomeric SMILES

CC(C)(C)NC(=O)CN(C1CC2=C(C=CC(=C2)C3=CC=CC=C3)N(C1)CC4=CN=CN4C)S(=O)(=O)C5=CN(C=N5)C

InChI

InChI=1S/C30H37N7O3S/c1-30(2,3)33-28(38)18-37(41(39,40)29-19-34(4)21-32-29)25-14-24-13-23(22-9-7-6-8-10-22)11-12-27(24)36(16-25)17-26-15-31-20-35(26)5/h6-13,15,19-21,25H,14,16-18H2,1-5H3,(H,33,38)