(2R)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: (2R)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide Openeye Name: (2R)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-thienylmethyl)propanamide CAS Name: (2R)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: (2R)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide Traditional Name: (2R)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(2-thenyl)propionamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CS1)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C21H23N3O2S2/c1-14(19(25)22-13-16-9-6-12-27-16)28-21-23-18-11-5-4-10-17(18)20(26)24(21)15-7-2-3-8-15/h4-6,9-12,14-15H,2-3,7-8,13H2,1H3,(H,22,25)/t14-/m1/s1