N,N-diethyl-4-(2-quinazolin-4-ylsulfanylethanoylamino)benzamide

Systemtic Name: N,N-diethyl-4-(2-quinazolin-4-ylsulfanylethanoylamino)benzamide Openeye Name: N,N-diethyl-4-[(2-quinazolin-4-ylsulfanylacetyl)amino]benzamide CAS Name: N,N-diethyl-4-[[1-oxo-2-(4-quinazolinylthio)ethyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[(2-quinazolin-4-ylsulfanylacetyl)amino]benzamide Traditional Name: N,N-diethyl-4-[[2-(quinazolin-4-ylthio)acetyl]amino]benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C21H22N4O2S/c1-3-25(4-2)21(27)15-9-11-16(12-10-15)24-19(26)13-28-20-17-7-5-6-8-18(17)22-14-23-20/h5-12,14H,3-4,13H2,1-2H3,(H,24,26)