1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-[2-[[methyl-(phenylmethyl)amino]methyl]phenyl]urea

Systemtic Name: 1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-[2-[[methyl-(phenylmethyl)amino]methyl]phenyl]urea Openeye Name: 1-[2-[[benzyl(methyl)amino]methyl]phenyl]-3-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)urea CAS Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-[2-[[methyl-(phenylmethyl)amino]methyl]phenyl]urea IUPAC Name: 1-[2-[[benzyl(methyl)amino]methyl]phenyl]-3-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)urea Traditional Name: 1-[2-[[benzyl(methyl)amino]methyl]phenyl]-3-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)urea Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)NC3=CC=CC=C3CN(C)CC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)NC3=CC=CC=C3CN(C)CC4=CC=CC=C4)O)C

InChI

InChI=1S/C28H30N4O3/c1-28(2)26(33)25(22-15-20(16-29)13-14-24(22)35-28)31-27(34)30-23-12-8-7-11-21(23)18-32(3)17-19-9-5-4-6-10-19/h4-15,25-26,33H,17-18H2,1-3H3,(H2,30,31,34)