1-[4-[(5-chloranyl-4-phenylazanyl-pyrimidin-2-yl)amino]phenoxy]-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: 1-[4-[(5-chloranyl-4-phenylazanyl-pyrimidin-2-yl)amino]phenoxy]-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-[4-[(4-anilino-5-chloro-pyrimidin-2-yl)amino]phenoxy]-3-(isopropylamino)propan-2-ol CAS Name: 1-[4-[(4-anilino-5-chloro-2-pyrimidinyl)amino]phenoxy]-3-(propan-2-ylamino)-2-propanol IUPAC Name: 1-[4-[(4-anilino-5-chloropyrimidin-2-yl)amino]phenoxy]-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-[4-[(4-anilino-5-chloro-pyrimidin-2-yl)amino]phenoxy]-3-(isopropylamino)propan-2-ol Formula: C22H26ClN5O2 MolecularWeight: 427.92714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)Cl)O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)Cl)O

InChI

InChI=1S/C22H26ClN5O2/c1-15(2)24-12-18(29)14-30-19-10-8-17(9-11-19)27-22-25-13-20(23)21(28-22)26-16-6-4-3-5-7-16/h3-11,13,15,18,24,29H,12,14H2,1-2H3,(H2,25,26,27,28)