4-morpholin-4-ylsulfonyl-N-[4-(3-phenyl-1-adamantyl)phenyl]benzamide

Systemtic Name: 4-morpholin-4-ylsulfonyl-N-[4-(3-phenyl-1-adamantyl)phenyl]benzamide Openeye Name: 4-morpholinosulfonyl-N-[4-(3-phenyl-1-adamantyl)phenyl]benzamide CAS Name: 4-(4-morpholinylsulfonyl)-N-[4-(3-phenyl-1-adamantyl)phenyl]benzamide IUPAC Name: 4-morpholin-4-ylsulfonyl-N-[4-(3-phenyl-1-adamantyl)phenyl]benzamide Traditional Name: 4-morpholinosulfonyl-N-[4-(3-phenyl-1-adamantyl)phenyl]benzamide Formula: C33H36N2O4S MolecularWeight: 556.71494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)(C5)C7=CC=CC=C7

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)(C5)C7=CC=CC=C7

InChI

InChI=1S/C33H36N2O4S/c36-31(26-6-12-30(13-7-26)40(37,38)35-14-16-39-17-15-35)34-29-10-8-28(9-11-29)33-21-24-18-25(22-33)20-32(19-24,23-33)27-4-2-1-3-5-27/h1-13,24-25H,14-23H2,(H,34,36)