2-[4-[(2-chlorophenyl)amino]quinazolin-2-yl]sulfanyl-N-[(2S)-1-methoxypropan-2-yl]ethanamide

Systemtic Name: 2-[4-[(2-chlorophenyl)amino]quinazolin-2-yl]sulfanyl-N-[(2S)-1-methoxypropan-2-yl]ethanamide Openeye Name: 2-[4-(2-chloroanilino)quinazolin-2-yl]sulfanyl-N-[(1S)-2-methoxy-1-methyl-ethyl]acetamide CAS Name: 2-[[4-(2-chloroanilino)-2-quinazolinyl]thio]-N-[(2S)-1-methoxypropan-2-yl]acetamide IUPAC Name: 2-[4-(2-chloroanilino)quinazolin-2-yl]sulfanyl-N-[(2S)-1-methoxypropan-2-yl]acetamide Traditional Name: 2-[[4-(2-chloroanilino)quinazolin-2-yl]thio]-N-[(1S)-2-methoxy-1-methyl-ethyl]acetamide Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3Cl

Isomeric SMILES

C[C@@H](COC)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4O2S/c1-13(11-27-2)22-18(26)12-28-20-24-16-9-5-3-7-14(16)19(25-20)23-17-10-6-4-8-15(17)21/h3-10,13H,11-12H2,1-2H3,(H,22,26)(H,23,24,25)/t13-/m0/s1