4-[(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 4-[(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-[(6-morpholino-4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]benzamide CAS Name: 4-[[6-(4-morpholinyl)-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl]methyl]-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-[(4-keto-6-morpholino-2-thioxo-1H-quinazolin-3-yl)methyl]benzamide Formula: C32H35N5O3S MolecularWeight: 569.717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CC(=C4)N5CCOCC5)NC3=S)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CC(=C4)N5CCOCC5)NC3=S)CC6=CC=CC=C6

InChI

InChI=1S/C32H35N5O3S/c38-30(33-26-12-14-35(15-13-26)21-23-4-2-1-3-5-23)25-8-6-24(7-9-25)22-37-31(39)28-20-27(36-16-18-40-19-17-36)10-11-29(28)34-32(37)41/h1-11,20,26H,12-19,21-22H2,(H,33,38)(H,34,41)