3-[4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]indol-1-yl]propan-1-ol

Systemtic Name: 3-[4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]indol-1-yl]propan-1-ol Openeye Name: 3-[4-[2-(3-chloroanilino)pyrimidin-4-yl]indol-1-yl]propan-1-ol CAS Name: 3-[4-[2-(3-chloroanilino)-4-pyrimidinyl]-1-indolyl]-1-propanol IUPAC Name: 3-[4-[2-(3-chloroanilino)pyrimidin-4-yl]indol-1-yl]propan-1-ol Traditional Name: 3-[4-[2-(3-chloroanilino)pyrimidin-4-yl]indol-1-yl]propan-1-ol Formula: C21H19ClN4O MolecularWeight: 378.85476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=C4C=CN(C4=CC=C3)CCCO

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=C4C=CN(C4=CC=C3)CCCO

InChI

InChI=1S/C21H19ClN4O/c22-15-4-1-5-16(14-15)24-21-23-10-8-19(25-21)17-6-2-7-20-18(17)9-12-26(20)11-3-13-27/h1-2,4-10,12,14,27H,3,11,13H2,(H,23,24,25)