N-(2-ethylhexyl)-4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]benzamide

Systemtic Name: N-(2-ethylhexyl)-4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]benzamide Openeye Name: N-(2-ethylhexyl)-4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]benzamide CAS Name: N-(2-ethylhexyl)-4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]benzamide IUPAC Name: N-(2-ethylhexyl)-4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]benzamide Traditional Name: N-(2-ethylhexyl)-4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]benzamide Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=CC=C(C=C1)CNC2=NC(=S)NC3=CC=CC=C32

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=CC=C(C=C1)CNC2=NC(=S)NC3=CC=CC=C32

InChI

InChI=1S/C24H30N4OS/c1-3-5-8-17(4-2)15-26-23(29)19-13-11-18(12-14-19)16-25-22-20-9-6-7-10-21(20)27-24(30)28-22/h6-7,9-14,17H,3-5,8,15-16H2,1-2H3,(H,26,29)(H2,25,27,28,30)