1-[1-[6-azanyl-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperidin-4-yl]-3-(4-propan-2-yloxyphenyl)urea

Systemtic Name: 1-[1-[6-azanyl-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperidin-4-yl]-3-(4-propan-2-yloxyphenyl)urea Openeye Name: 1-[1-[6-amino-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]-4-piperidyl]-3-(4-isopropoxyphenyl)urea CAS Name: 1-[1-[6-amino-5-[(E)-methoxyiminomethyl]-4-pyrimidinyl]-4-piperidinyl]-3-(4-propan-2-yloxyphenyl)urea IUPAC Name: 1-[1-[6-amino-5-[(E)-methoxyiminomethyl]pyrimidin-4-yl]piperidin-4-yl]-3-(4-propan-2-yloxyphenyl)urea Traditional Name: 1-[1-[6-amino-5-[(E)-methyloximinomethyl]pyrimidin-4-yl]-4-piperidyl]-3-(4-isopropoxyphenyl)urea Formula: C21H29N7O3 MolecularWeight: 427.50006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)NC2CCN(CC2)C3=C(C(=NC=N3)N)C=NOC

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)NC2CCN(CC2)C3=C(C(=NC=N3)N)/C=N/OC

InChI

InChI=1S/C21H29N7O3/c1-14(2)31-17-6-4-15(5-7-17)26-21(29)27-16-8-10-28(11-9-16)20-18(12-25-30-3)19(22)23-13-24-20/h4-7,12-14,16H,8-11H2,1-3H3,(H2,22,23,24)(H2,26,27,29)/b25-12+