4-(cyclohexylcarbamoylamino)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)butanamide

Systemtic Name: 4-(cyclohexylcarbamoylamino)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(cyclohexylcarbamoylamino)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide CAS Name: 4-[[(cyclohexylamino)-oxomethyl]amino]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(cyclohexylcarbamoylamino)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide Traditional Name: N-benzyl-4-(cyclohexylcarbamoylamino)-N-[(4-keto-1H-quinazolin-2-yl)methyl]butyramide Formula: C27H33N5O3 MolecularWeight: 475.58262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCCC(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCCC(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C27H33N5O3/c33-25(16-9-17-28-27(35)29-21-12-5-2-6-13-21)32(18-20-10-3-1-4-11-20)19-24-30-23-15-8-7-14-22(23)26(34)31-24/h1,3-4,7-8,10-11,14-15,21H,2,5-6,9,12-13,16-19H2,(H2,28,29,35)(H,30,31,34)