1-(2-methylpropyl)-N-methylsulfinyl-2-[1-(3-oxidanylpropyl)imidazol-2-yl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 1-(2-methylpropyl)-N-methylsulfinyl-2-[1-(3-oxidanylpropyl)imidazol-2-yl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 2-[1-(3-hydroxypropyl)imidazol-2-yl]-1-isobutyl-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 2-[1-(3-hydroxypropyl)-2-imidazolyl]-1-(2-methylpropyl)-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 2-[1-(3-hydroxypropyl)imidazol-2-yl]-1-(2-methylpropyl)-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 2-[1-(3-hydroxypropyl)imidazol-2-yl]-1-isobutyl-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)S(=O)C)C4=NC=CN4CCCO

Isomeric SMILES

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)S(=O)C)C4=NC=CN4CCCO

InChI

InChI=1S/C28H34N4O3S/c1-21(2)20-31-25-13-8-7-10-22(25)18-23(19-26(31)27-29-14-16-30(27)15-9-17-33)28(34)32(36(3)35)24-11-5-4-6-12-24/h4-8,10-14,16,18,21,26,33H,9,15,17,19-20H2,1-3H3