6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(quinoxalin-5-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(quinoxalin-5-ylmethyl)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-6-[(3-methoxyphenyl)methoxy]-4-(quinoxalin-5-ylmethyl)-1,4-diazepan-2-one CAS Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(5-quinoxalinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(quinoxalin-5-ylmethyl)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-6-m-anisyloxy-4-(quinoxalin-5-ylmethyl)-1,4-diazepan-2-one Formula: C26H32N4O3 MolecularWeight: 448.55728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=C3C(=CC=C2)N=CC=N3)OCC4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=C3C(=CC=C2)N=CC=N3)OCC4=CC(=CC=C4)OC

InChI

InChI=1S/C26H32N4O3/c1-19(2)13-30-16-23(33-18-20-6-4-8-22(12-20)32-3)15-29(17-25(30)31)14-21-7-5-9-24-26(21)28-11-10-27-24/h4-12,19,23H,13-18H2,1-3H3