(2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-propanamide

Systemtic Name: (2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-propanamide Openeye Name: (2S)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-propanamide CAS Name: (2S)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide IUPAC Name: (2S)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide Traditional Name: (2S)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-propionamide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C27H32N4O3S/c1-4-19-11-5-9-15-22(19)28-24(32)17-30(3)25(33)18(2)35-27-29-23-16-10-8-14-21(23)26(34)31(27)20-12-6-7-13-20/h5,8-11,14-16,18,20H,4,6-7,12-13,17H2,1-3H3,(H,28,32)/t18-/m0/s1