methyl 3-(ethylaminomethyl)-1-[2-(phenylsulfonyl)-2-propan-2-ylsulfonyl-ethyl]indole-5-carboxylate

Systemtic Name: methyl 3-(ethylaminomethyl)-1-[2-(phenylsulfonyl)-2-propan-2-ylsulfonyl-ethyl]indole-5-carboxylate Openeye Name: methyl 1-[2-(benzenesulfonyl)-2-isopropylsulfonyl-ethyl]-3-(ethylaminomethyl)indole-5-carboxylate CAS Name: 1-[2-(benzenesulfonyl)-2-propan-2-ylsulfonylethyl]-3-(ethylaminomethyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(benzenesulfonyl)-2-propan-2-ylsulfonylethyl]-3-(ethylaminomethyl)indole-5-carboxylate Traditional Name: 1-(2-besyl-2-isopropylsulfonyl-ethyl)-3-(ethylaminomethyl)indole-5-carboxylic acid methyl ester Formula: C24H30N2O6S2 MolecularWeight: 506.6348

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C24H30N2O6S2/c1-5-25-14-19-15-26(22-12-11-18(13-21(19)22)24(27)32-4)16-23(33(28,29)17(2)3)34(30,31)20-9-7-6-8-10-20/h6-13,15,17,23,25H,5,14,16H2,1-4H3