N-[4-(1-adamantyl)phenyl]-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]benzamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-[benzyl-(4-methoxyphenyl)sulfonylamino]benzamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]benzamide Formula: C37H38N2O4S MolecularWeight: 606.77362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C37H38N2O4S/c1-43-32-15-17-33(18-16-32)44(41,42)39(25-26-7-3-2-4-8-26)35-10-6-5-9-34(35)36(40)38-31-13-11-30(12-14-31)37-22-27-19-28(23-37)21-29(20-27)24-37/h2-18,27-29H,19-25H2,1H3,(H,38,40)