(2S)-2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-4-pyrazolyl]-3-propyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methylpyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(NC2=CC=CC=C2C1=O)C3=CN(N=C3C4=CC5=C(C=C4)OCCCO5)C

Isomeric SMILES

CCCN1[C@H](NC2=CC=CC=C2C1=O)C3=CN(N=C3C4=CC5=C(C=C4)OCCCO5)C

InChI

InChI=1S/C24H26N4O3/c1-3-11-28-23(25-19-8-5-4-7-17(19)24(28)29)18-15-27(2)26-22(18)16-9-10-20-21(14-16)31-13-6-12-30-20/h4-5,7-10,14-15,23,25H,3,6,11-13H2,1-2H3/t23-/m0/s1