1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-(prop-2-ynylamino)quinazolin-2-one

Systemtic Name: 1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-(prop-2-ynylamino)quinazolin-2-one Openeye Name: 1-benzyl-4-(4-isopropylphenyl)-6-(prop-2-ynylamino)quinazolin-2-one CAS Name: 1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-(prop-2-ynylamino)-2-quinazolinone IUPAC Name: 1-benzyl-4-(4-propan-2-ylphenyl)-6-(prop-2-ynylamino)quinazolin-2-one Traditional Name: 1-benzyl-4-p-cumenyl-6-(propargylamino)quinazolin-2-one Formula: C27H25N3O MolecularWeight: 407.5069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=O)N(C3=C2C=C(C=C3)NCC#C)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=O)N(C3=C2C=C(C=C3)NCC#C)CC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O/c1-4-16-28-23-14-15-25-24(17-23)26(22-12-10-21(11-13-22)19(2)3)29-27(31)30(25)18-20-8-6-5-7-9-20/h1,5-15,17,19,28H,16,18H2,2-3H3