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N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]thiophene-3-carboxamide

N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]thiophene-3-carboxamide

Systemtic Name:N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]thiophene-3-carboxamide
Openeye Name:N-[4-[2,4-diamino-6-(benzyloxymethyl)pyrimidin-5-yl]phenyl]thiophene-3-carboxamide
CAS Name:N-[4-[2,4-diamino-6-(phenylmethoxymethyl)-5-pyrimidinyl]phenyl]-3-thiophenecarboxamide
IUPAC Name:N-[4-[2,4-diamino-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]thiophene-3-carboxamide
Traditional Name:N-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]thiophene-3-carboxamide
Formula: C23H21N5O2S
MolecularWeight: 431.51014
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NC(=O)C4=CSC=C4


Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NC(=O)C4=CSC=C4


InChI

InChI=1S/C23H21N5O2S/c24-21-20(16-6-8-18(9-7-16)26-22(29)17-10-11-31-14-17)19(27-23(25)28-21)13-30-12-15-4-2-1-3-5-15/h1-11,14H,12-13H2,(H,26,29)(H4,24,25,27,28)


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