N-tert-butyl-2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-tert-butyl-2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-tert-butyl-2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-tert-butyl-2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-N-tert-butyl-2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]acetamide Formula: C30H33N3O2S MolecularWeight: 499.66692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CC4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CC4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C30H33N3O2S/c1-21(2)23-15-10-12-18-26(23)33-28(35)24-16-9-11-17-25(24)31-29(33)36-20-27(34)32(30(3,4)5)19-22-13-7-6-8-14-22/h6-18,21H,19-20H2,1-5H3