N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]cycloheptanecarboxamide

Systemtic Name: N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]cycloheptanecarboxamide Openeye Name: N-[4-[2,4-diamino-6-(benzyloxymethyl)pyrimidin-5-yl]phenyl]cycloheptanecarboxamide CAS Name: N-[4-[2,4-diamino-6-(phenylmethoxymethyl)-5-pyrimidinyl]phenyl]cycloheptanecarboxamide IUPAC Name: N-[4-[2,4-diamino-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]cycloheptanecarboxamide Traditional Name: N-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]cycloheptanecarboxamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)NC2=CC=C(C=C2)C3=C(N=C(N=C3N)N)COCC4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)C(=O)NC2=CC=C(C=C2)C3=C(N=C(N=C3N)N)COCC4=CC=CC=C4

InChI

InChI=1S/C26H31N5O2/c27-24-23(22(30-26(28)31-24)17-33-16-18-8-4-3-5-9-18)19-12-14-21(15-13-19)29-25(32)20-10-6-1-2-7-11-20/h3-5,8-9,12-15,20H,1-2,6-7,10-11,16-17H2,(H,29,32)(H4,27,28,30,31)