methyl 1-(3-phenyl-2-propan-2-ylsulfonyl-propyl)-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-(3-phenyl-2-propan-2-ylsulfonyl-propyl)-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate Openeye Name: methyl 3-[(isopropylsulfonylamino)methyl]-1-(2-isopropylsulfonyl-3-phenyl-propyl)indole-5-carboxylate CAS Name: 1-(3-phenyl-2-propan-2-ylsulfonylpropyl)-3-[(propan-2-ylsulfonylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-phenyl-2-propan-2-ylsulfonylpropyl)-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate Traditional Name: 3-[(isopropylsulfonylamino)methyl]-1-(2-isopropylsulfonyl-3-phenyl-propyl)indole-5-carboxylic acid methyl ester Formula: C26H34N2O6S2 MolecularWeight: 534.68796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNS(=O)(=O)C(C)C

Isomeric SMILES

CC(C)S(=O)(=O)C(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNS(=O)(=O)C(C)C

InChI

InChI=1S/C26H34N2O6S2/c1-18(2)35(30,31)23(13-20-9-7-6-8-10-20)17-28-16-22(15-27-36(32,33)19(3)4)24-14-21(26(29)34-5)11-12-25(24)28/h6-12,14,16,18-19,23,27H,13,15,17H2,1-5H3