(2S)-N-aminocarbonyl-2-[4-[(2-chlorophenyl)amino]quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-aminocarbonyl-2-[4-[(2-chlorophenyl)amino]quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-carbamoyl-2-[4-(2-chloroanilino)quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-carbamoyl-2-[[4-(2-chloroanilino)-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-carbamoyl-2-[4-(2-chloroanilino)quinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-carbamoyl-2-[[4-(2-chloroanilino)quinazolin-2-yl]thio]propionamide Formula: C18H16ClN5O2S MolecularWeight: 401.86994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3Cl

Isomeric SMILES

C[C@@H](C(=O)NC(=O)N)SC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3Cl

InChI

InChI=1S/C18H16ClN5O2S/c1-10(16(25)24-17(20)26)27-18-22-13-8-4-2-6-11(13)15(23-18)21-14-9-5-3-7-12(14)19/h2-10H,1H3,(H,21,22,23)(H3,20,24,25,26)/t10-/m0/s1