(2S)-2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: (2S)-2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)propanamide Openeye Name: (2S)-2-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-thienylmethyl)propanamide CAS Name: (2S)-2-[[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: (2S)-2-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)propanamide Traditional Name: (2S)-2-[[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-N-(2-thenyl)propionamide Formula: C23H20ClN3O2S2 MolecularWeight: 470.0068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C23H20ClN3O2S2/c1-14-18(24)9-5-11-20(14)27-22(29)17-8-3-4-10-19(17)26-23(27)31-15(2)21(28)25-13-16-7-6-12-30-16/h3-12,15H,13H2,1-2H3,(H,25,28)/t15-/m0/s1