5-azanyl-N-butyl-2,7,7-trimethyl-9-(3-methylsulfonyl-2,4-dihydroquinazolin-1-yl)-4-oxidanyl-9-oxidanylidene-nonanamide

Systemtic Name: 5-azanyl-N-butyl-2,7,7-trimethyl-9-(3-methylsulfonyl-2,4-dihydroquinazolin-1-yl)-4-oxidanyl-9-oxidanylidene-nonanamide Openeye Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-(3-methylsulfonyl-2,4-dihydroquinazolin-1-yl)-9-oxo-nonanamide CAS Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-(3-methylsulfonyl-2,4-dihydroquinazolin-1-yl)-9-oxononanamide IUPAC Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-(3-methylsulfonyl-2,4-dihydroquinazolin-1-yl)-9-oxononanamide Traditional Name: 5-amino-N-butyl-4-hydroxy-9-keto-9-(3-mesyl-2,4-dihydroquinazolin-1-yl)-2,7,7-trimethyl-pelargonamide Formula: C25H42N4O5S MolecularWeight: 510.68978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CN(CC2=CC=CC=C21)S(=O)(=O)C)N)O

Isomeric SMILES

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CN(CC2=CC=CC=C21)S(=O)(=O)C)N)O

InChI

InChI=1S/C25H42N4O5S/c1-6-7-12-27-24(32)18(2)13-22(30)20(26)14-25(3,4)15-23(31)29-17-28(35(5,33)34)16-19-10-8-9-11-21(19)29/h8-11,18,20,22,30H,6-7,12-17,26H2,1-5H3,(H,27,32)