2-[1-(2-methylpropyl)benzimidazol-2-yl]-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline

Systemtic Name: 2-[1-(2-methylpropyl)benzimidazol-2-yl]-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline Openeye Name: 2-(1-isobutylbenzimidazol-2-yl)-4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazoline CAS Name: 2-[1-(2-methylpropyl)-2-benzimidazolyl]-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline IUPAC Name: 2-[1-(2-methylpropyl)benzimidazol-2-yl]-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline Traditional Name: 2-(1-isobutylbenzimidazol-2-yl)-4-p-cumenyl-6-propargyloxy-quinazoline Formula: C31H30N4O MolecularWeight: 474.5961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1C3=NC4=C(C=C(C=C4)OCC#C)C(=N3)C5=CC=C(C=C5)C(C)C

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1C3=NC4=C(C=C(C=C4)OCC#C)C(=N3)C5=CC=C(C=C5)C(C)C

InChI

InChI=1S/C31H30N4O/c1-6-17-36-24-15-16-26-25(18-24)29(23-13-11-22(12-14-23)21(4)5)34-30(32-26)31-33-27-9-7-8-10-28(27)35(31)19-20(2)3/h1,7-16,18,20-21H,17,19H2,2-5H3