2-[4-[6-azanyl-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]oxyphenyl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[6-azanyl-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]oxyphenyl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[6-amino-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]oxyphenyl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[[6-amino-5-[(E)-methoxyiminomethyl]-4-pyrimidinyl]oxy]phenyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[6-amino-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]oxyphenyl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[6-amino-5-[(E)-methyloximinomethyl]pyrimidin-4-yl]oxyphenyl]-N-(p-tolyl)acetamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2=CC=C(C=C2)OC3=NC=NC(=C3C=NOC)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC2=CC=C(C=C2)OC3=NC=NC(=C3/C=N/OC)N

InChI

InChI=1S/C21H21N5O3/c1-14-3-7-16(8-4-14)26-19(27)11-15-5-9-17(10-6-15)29-21-18(12-25-28-2)20(22)23-13-24-21/h3-10,12-13H,11H2,1-2H3,(H,26,27)(H2,22,23,24)/b25-12+