4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-(1,3-thiazol-5-ylmethyl)benzamide

Systemtic Name: 4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-(1,3-thiazol-5-ylmethyl)benzamide Openeye Name: 4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-(thiazol-5-ylmethyl)benzamide CAS Name: 4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]-N-(5-thiazolylmethyl)benzamide IUPAC Name: 4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]-N-(1,3-thiazol-5-ylmethyl)benzamide Traditional Name: 4-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl-propargyl-amino]-N-(thiazol-5-ylmethyl)benzamide Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)C3=CC=C(C=C3)C(=O)NCC4=CN=CS4

Isomeric SMILES

CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)C3=CC=C(C=C3)C(=O)NCC4=CN=CS4

InChI

InChI=1S/C24H21N5O2S/c1-3-10-29(14-17-4-9-22-21(11-17)24(31)28-16(2)27-22)19-7-5-18(6-8-19)23(30)26-13-20-12-25-15-32-20/h1,4-9,11-12,15H,10,13-14H2,2H3,(H,26,30)(H,27,28,31)