ethyl 4-[2,5-dimethyl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[2,5-dimethyl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[2,5-dimethyl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrrol-1-yl]benzoate CAS Name: 4-[2,5-dimethyl-3-[[4-(1-pyrrolidinylsulfonyl)phenyl]iminomethyl]-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,5-dimethyl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrrol-1-yl]benzoate Traditional Name: 4-[2,5-dimethyl-3-[(4-pyrrolidinosulfonylphenyl)iminomethyl]pyrrol-1-yl]benzoic acid ethyl ester Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C26H29N3O4S/c1-4-33-26(30)21-7-11-24(12-8-21)29-19(2)17-22(20(29)3)18-27-23-9-13-25(14-10-23)34(31,32)28-15-5-6-16-28/h7-14,17-18H,4-6,15-16H2,1-3H3