N-butyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide

Systemtic Name: N-butyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide Openeye Name: N-butyl-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide CAS Name: N-butyl-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide IUPAC Name: N-butyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide Traditional Name: N-butyl-2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[(4-keto-1H-quinazolin-2-yl)methyl]acetamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSCC3=C(ON=C3C)C

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSCC3=C(ON=C3C)C

InChI

InChI=1S/C21H26N4O3S/c1-4-5-10-25(20(26)13-29-12-17-14(2)24-28-15(17)3)11-19-22-18-9-7-6-8-16(18)21(27)23-19/h6-9H,4-5,10-13H2,1-3H3,(H,22,23,27)