1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline-2-thione

Systemtic Name: 1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline-2-thione Openeye Name: 1-benzyl-4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazoline-2-thione CAS Name: 1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinethione IUPAC Name: 1-benzyl-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline-2-thione Traditional Name: 1-benzyl-4-p-cumenyl-6-propargyloxy-quinazoline-2-thione Formula: C27H24N2OS MolecularWeight: 424.55726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=S)N(C3=C2C=C(C=C3)OCC#C)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=S)N(C3=C2C=C(C=C3)OCC#C)CC4=CC=CC=C4

InChI

InChI=1S/C27H24N2OS/c1-4-16-30-23-14-15-25-24(17-23)26(22-12-10-21(11-13-22)19(2)3)28-27(31)29(25)18-20-8-6-5-7-9-20/h1,5-15,17,19H,16,18H2,2-3H3