N-[3-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: N-[3-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoylamino]phenyl]propanamide Openeye Name: N-[3-[[2-(2-isopropylquinazolin-4-yl)sulfanylacetyl]amino]phenyl]propanamide CAS Name: N-[3-[[1-oxo-2-[(2-propan-2-yl-4-quinazolinyl)thio]ethyl]amino]phenyl]propanamide IUPAC Name: N-[3-[[2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[3-[[2-[(2-isopropylquinazolin-4-yl)thio]acetyl]amino]phenyl]propionamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(C)C

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(C)C

InChI

InChI=1S/C22H24N4O2S/c1-4-19(27)23-15-8-7-9-16(12-15)24-20(28)13-29-22-17-10-5-6-11-18(17)25-21(26-22)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,23,27)(H,24,28)