6,8-bis(chloranyl)-4-piperazin-1-yl-quinazoline; N-(4-propan-2-ylphenyl)methanamide

Systemtic Name: 6,8-bis(chloranyl)-4-piperazin-1-yl-quinazoline; N-(4-propan-2-ylphenyl)methanamide Openeye Name: 6,8-dichloro-4-piperazin-1-yl-quinazoline; N-(4-isopropylphenyl)formamide CAS Name: 6,8-dichloro-4-(1-piperazinyl)quinazoline; N-(4-propan-2-ylphenyl)formamide IUPAC Name: 6,8-dichloro-4-piperazin-1-ylquinazoline; N-(4-propan-2-ylphenyl)formamide Traditional Name: 6,8-dichloro-4-piperazino-quinazoline; N-p-cumenylformamide Formula: C22H25Cl2N5O MolecularWeight: 446.3728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC=O.C1CN(CCN1)C2=NC=NC3=C(C=C(C=C32)Cl)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC=O.C1CN(CCN1)C2=NC=NC3=C(C=C(C=C32)Cl)Cl

InChI

InChI=1S/C12H12Cl2N4.C10H13NO/c13-8-5-9-11(10(14)6-8)16-7-17-12(9)18-3-1-15-2-4-18;1-8(2)9-3-5-10(6-4-9)11-7-12/h5-7,15H,1-4H2;3-8H,1-2H3,(H,11,12)