5-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]-N-(oxan-4-yl)-3-phenyl-1H-indole-2-carboxamide

Systemtic Name: 5-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]-N-(oxan-4-yl)-3-phenyl-1H-indole-2-carboxamide Openeye Name: 5-[benzyl-(4-tert-butylphenyl)sulfonyl-amino]-3-phenyl-N-tetrahydropyran-4-yl-1H-indole-2-carboxamide CAS Name: 5-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]-N-(4-oxanyl)-3-phenyl-1H-indole-2-carboxamide IUPAC Name: 5-[benzyl-(4-tert-butylphenyl)sulfonylamino]-N-(oxan-4-yl)-3-phenyl-1H-indole-2-carboxamide Traditional Name: 5-[benzyl-(4-tert-butylphenyl)sulfonyl-amino]-3-phenyl-N-tetrahydropyran-4-yl-1H-indole-2-carboxamide Formula: C37H39N3O4S MolecularWeight: 621.78826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC4=C(C=C3)NC(=C4C5=CC=CC=C5)C(=O)NC6CCOCC6

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC4=C(C=C3)NC(=C4C5=CC=CC=C5)C(=O)NC6CCOCC6

InChI

InChI=1S/C37H39N3O4S/c1-37(2,3)28-14-17-31(18-15-28)45(42,43)40(25-26-10-6-4-7-11-26)30-16-19-33-32(24-30)34(27-12-8-5-9-13-27)35(39-33)36(41)38-29-20-22-44-23-21-29/h4-19,24,29,39H,20-23,25H2,1-3H3,(H,38,41)