methyl 1-[2-(phenylmethyl)pentyl]-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-[2-(phenylmethyl)pentyl]-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate Openeye Name: methyl 1-(2-benzylpentyl)-3-[(isopropylsulfonylamino)methyl]indole-5-carboxylate CAS Name: 1-[2-(phenylmethyl)pentyl]-3-[(propan-2-ylsulfonylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzylpentyl)-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate Traditional Name: 1-(2-benzylpentyl)-3-[(isopropylsulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C26H34N2O4S MolecularWeight: 470.62416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2O4S/c1-5-9-21(14-20-10-7-6-8-11-20)17-28-18-23(16-27-33(30,31)19(2)3)24-15-22(26(29)32-4)12-13-25(24)28/h6-8,10-13,15,18-19,21,27H,5,9,14,16-17H2,1-4H3