6-[2-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]hexanamide

Systemtic Name: 6-[2-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]hexanamide Openeye Name: 6-[2-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]hexanamide CAS Name: 6-[2-[[2-(3-isoxazolylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]hexanamide IUPAC Name: 6-[2-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]hexanamide Traditional Name: 6-[2-[[2-(isoxazol-3-ylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]hexanamide Formula: C19H21N5O4S MolecularWeight: 415.46614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=NOC=C3)CCCCCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=NOC=C3)CCCCCC(=O)N

InChI

InChI=1S/C19H21N5O4S/c20-15(25)8-2-1-5-10-24-18(27)13-6-3-4-7-14(13)21-19(24)29-12-17(26)22-16-9-11-28-23-16/h3-4,6-7,9,11H,1-2,5,8,10,12H2,(H2,20,25)(H,22,23,26)