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

Systemtic Name: 4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide Openeye Name: 4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-[(4-methylthiazol-2-yl)methyl]benzamide CAS Name: 4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]-N-[(4-methyl-2-thiazolyl)methyl]benzamide IUPAC Name: 4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide Traditional Name: 4-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl-propargyl-amino]-N-[(4-methylthiazol-2-yl)methyl]benzamide Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)CNC(=O)C2=CC=C(C=C2)N(CC#C)CC3=CC4=C(C=C3)NC(=NC4=O)C

Isomeric SMILES

CC1=CSC(=N1)CNC(=O)C2=CC=C(C=C2)N(CC#C)CC3=CC4=C(C=C3)NC(=NC4=O)C

InChI

InChI=1S/C25H23N5O2S/c1-4-11-30(14-18-5-10-22-21(12-18)25(32)29-17(3)28-22)20-8-6-19(7-9-20)24(31)26-13-23-27-16(2)15-33-23/h1,5-10,12,15H,11,13-14H2,2-3H3,(H,26,31)(H,28,29,32)