1-[4-[6-azanyl-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone

Systemtic Name: 1-[4-[6-azanyl-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone Openeye Name: 1-[4-[6-amino-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperazin-1-yl]-2-(4-isopropylphenyl)ethanone CAS Name: 1-[4-[6-amino-5-[(E)-methoxyiminomethyl]-4-pyrimidinyl]-1-piperazinyl]-2-(4-propan-2-ylphenyl)ethanone IUPAC Name: 1-[4-[6-amino-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone Traditional Name: 1-[4-[6-amino-5-[(E)-methyloximinomethyl]pyrimidin-4-yl]piperazino]-2-p-cumenyl-ethanone Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=C(C(=NC=N3)N)C=NOC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=C(C(=NC=N3)N)/C=N/OC

InChI

InChI=1S/C21H28N6O2/c1-15(2)17-6-4-16(5-7-17)12-19(28)26-8-10-27(11-9-26)21-18(13-25-29-3)20(22)23-14-24-21/h4-7,13-15H,8-12H2,1-3H3,(H2,22,23,24)/b25-13+