1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(7H-purin-6-ylamino)propan-1-one

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(7H-purin-6-ylamino)propan-1-one Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(7H-purin-6-ylamino)propan-1-one CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-(7H-purin-6-ylamino)-1-propanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(7H-purin-6-ylamino)propan-1-one Traditional Name: 1-[4-(4-methoxyphenyl)piperazino]-3-(7H-purin-6-ylamino)propan-1-one Formula: C19H23N7O2 MolecularWeight: 381.43162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCNC3=NC=NC4=C3NC=N4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCNC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C19H23N7O2/c1-28-15-4-2-14(3-5-15)25-8-10-26(11-9-25)16(27)6-7-20-18-17-19(22-12-21-17)24-13-23-18/h2-5,12-13H,6-11H2,1H3,(H2,20,21,22,23,24)