(2S)-2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-3-cyclopentyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-3-cyclopentyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-3-cyclopentyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-3-cyclopentyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-3-cyclopentyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-3-cyclopentyl-1,2-dihydroquinazolin-4-one Formula: C22H21ClN4O MolecularWeight: 392.88134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(NC3=CC=CC=C3C2=O)C4=C(NN=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCC(C1)N2[C@H](NC3=CC=CC=C3C2=O)C4=C(NN=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C22H21ClN4O/c23-15-11-9-14(10-12-15)20-18(13-24-26-20)21-25-19-8-4-3-7-17(19)22(28)27(21)16-5-1-2-6-16/h3-4,7-13,16,21,25H,1-2,5-6H2,(H,24,26)/t21-/m0/s1