(2R)-2-[3-(4-butylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclopropylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[3-(4-butylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclopropylcarbamoyl)propanamide Openeye Name: (2R)-2-[3-(4-butylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(cyclopropylcarbamoyl)propanamide CAS Name: (2R)-2-[[3-(4-butylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(cyclopropylamino)-oxomethyl]propanamide IUPAC Name: (2R)-2-[3-(4-butylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(cyclopropylcarbamoyl)propanamide Traditional Name: (2R)-2-[[3-(4-butylphenyl)-4-keto-quinazolin-2-yl]thio]-N-(cyclopropylcarbamoyl)propionamide Formula: C25H28N4O3S MolecularWeight: 464.57982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)NC4CC4

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC(=O)NC4CC4

InChI

InChI=1S/C25H28N4O3S/c1-3-4-7-17-10-14-19(15-11-17)29-23(31)20-8-5-6-9-21(20)27-25(29)33-16(2)22(30)28-24(32)26-18-12-13-18/h5-6,8-11,14-16,18H,3-4,7,12-13H2,1-2H3,(H2,26,28,30,32)/t16-/m1/s1