ethyl 5-methoxy-1-methyl-2-[(4-phenylpiperazin-1-yl)methyl]-4-(phenylsulfonyl)indole-3-carboxylate

Systemtic Name: ethyl 5-methoxy-1-methyl-2-[(4-phenylpiperazin-1-yl)methyl]-4-(phenylsulfonyl)indole-3-carboxylate Openeye Name: ethyl 4-(benzenesulfonyl)-5-methoxy-1-methyl-2-[(4-phenylpiperazin-1-yl)methyl]indole-3-carboxylate CAS Name: 4-(benzenesulfonyl)-5-methoxy-1-methyl-2-[(4-phenyl-1-piperazinyl)methyl]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzenesulfonyl)-5-methoxy-1-methyl-2-[(4-phenylpiperazin-1-yl)methyl]indole-3-carboxylate Traditional Name: 4-besyl-5-methoxy-1-methyl-2-[(4-phenylpiperazino)methyl]indole-3-carboxylic acid ethyl ester Formula: C30H33N3O5S MolecularWeight: 547.66512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3)C)CN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3)C)CN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N3O5S/c1-4-38-30(34)28-25(21-32-17-19-33(20-18-32)22-11-7-5-8-12-22)31(2)24-15-16-26(37-3)29(27(24)28)39(35,36)23-13-9-6-10-14-23/h5-16H,4,17-21H2,1-3H3