3-[(1S)-1-cyclohexyl-4-[cyclohexyl(1H-pyrazol-4-ylmethyl)amino]butyl]-6-phenoxy-4H-quinazolin-2-amine

Systemtic Name: 3-[(1S)-1-cyclohexyl-4-[cyclohexyl(1H-pyrazol-4-ylmethyl)amino]butyl]-6-phenoxy-4H-quinazolin-2-amine Openeye Name: 3-[(1S)-1-cyclohexyl-4-[cyclohexyl(1H-pyrazol-4-ylmethyl)amino]butyl]-6-phenoxy-4H-quinazolin-2-amine CAS Name: 3-[(1S)-1-cyclohexyl-4-[cyclohexyl(1H-pyrazol-4-ylmethyl)amino]butyl]-6-phenoxy-4H-quinazolin-2-amine IUPAC Name: 3-[(1S)-1-cyclohexyl-4-[cyclohexyl(1H-pyrazol-4-ylmethyl)amino]butyl]-6-phenoxy-4H-quinazolin-2-amine Traditional Name: [(4S)-4-(2-amino-6-phenoxy-4H-quinazolin-3-yl)-4-cyclohexyl-butyl]-cyclohexyl-(1H-pyrazol-4-ylmethyl)amine Formula: C34H46N6O MolecularWeight: 554.76864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CCCN(CC2=CNN=C2)C3CCCCC3)N4CC5=C(C=CC(=C5)OC6=CC=CC=C6)N=C4N

Isomeric SMILES

C1CCC(CC1)[C@H](CCCN(CC2=CNN=C2)C3CCCCC3)N4CC5=C(C=CC(=C5)OC6=CC=CC=C6)N=C4N

InChI

InChI=1S/C34H46N6O/c35-34-38-32-19-18-31(41-30-15-8-3-9-16-30)21-28(32)25-40(34)33(27-11-4-1-5-12-27)17-10-20-39(24-26-22-36-37-23-26)29-13-6-2-7-14-29/h3,8-9,15-16,18-19,21-23,27,29,33H,1-2,4-7,10-14,17,20,24-25H2,(H2,35,38)(H,36,37)/t33-/m0/s1