N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-(8-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-4-(8-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-4-(8-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-(4-keto-8-methyl-quinazolin-3-yl)butyramide Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCC3=C(N(N=C3C)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCC3=C(N(N=C3C)CC4=CC=CC=C4)C

InChI

InChI=1S/C26H29N5O2/c1-18-9-7-12-22-25(18)28-17-30(26(22)33)14-8-13-24(32)27-15-23-19(2)29-31(20(23)3)16-21-10-5-4-6-11-21/h4-7,9-12,17H,8,13-16H2,1-3H3,(H,27,32)