(2,4-dichlorophenyl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone

Systemtic Name: (2,4-dichlorophenyl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone Openeye Name: (2,4-dichlorophenyl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone CAS Name: (2,4-dichlorophenyl)-[4-(7H-purin-6-yl)-1-piperazinyl]methanone IUPAC Name: (2,4-dichlorophenyl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone Traditional Name: (2,4-dichlorophenyl)-[4-(7H-purin-6-yl)piperazino]methanone Formula: C16H14Cl2N6O MolecularWeight: 377.22796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2NC=N3)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2NC=N3)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C16H14Cl2N6O/c17-10-1-2-11(12(18)7-10)16(25)24-5-3-23(4-6-24)15-13-14(20-8-19-13)21-9-22-15/h1-2,7-9H,3-6H2,(H,19,20,21,22)