(2S)-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)propanamide

Systemtic Name: (2S)-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)propanamide Openeye Name: (2S)-2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-methoxyphenyl)propanamide CAS Name: (2S)-2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-(2-methoxyphenyl)propanamide IUPAC Name: (2S)-2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)propanamide Traditional Name: (2S)-2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-(2-methoxyphenyl)propionamide Formula: C23H26ClN3O3S MolecularWeight: 459.98884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1OC)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

InChI

InChI=1S/C23H26ClN3O3S/c1-14(2)11-12-27-22(29)17-10-9-16(24)13-19(17)26-23(27)31-15(3)21(28)25-18-7-5-6-8-20(18)30-4/h5-10,13-15H,11-12H2,1-4H3,(H,25,28)/t15-/m0/s1