(2S)-2-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-3-propyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)-3-propyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one Formula: C26H25N5O MolecularWeight: 423.5096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(NC2=CC=CC=C2C1=O)C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CCCN1[C@H](NC2=CC=CC=C2C1=O)C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H25N5O/c1-2-15-31-25(28-23-13-7-6-12-21(23)26(31)32)22-18-30(17-19-9-4-3-5-10-19)29-24(22)20-11-8-14-27-16-20/h3-14,16,18,25,28H,2,15,17H2,1H3/t25-/m0/s1