N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[2-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[2-(2,4-dichlorobenzyl)pyrazol-3-yl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C21H17Cl2N5O2 MolecularWeight: 442.29798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H17Cl2N5O2/c22-14-6-5-13(16(23)11-14)12-28-19(9-10-24-28)27-20(29)8-7-18-25-17-4-2-1-3-15(17)21(30)26-18/h1-6,9-11H,7-8,12H2,(H,27,29)(H,25,26,30)