ethyl 4-[5-chloranyl-2-(3-methylbut-2-enylamino)phenyl]sulfonyl-1-(3-methylbut-2-enyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[5-chloranyl-2-(3-methylbut-2-enylamino)phenyl]sulfonyl-1-(3-methylbut-2-enyl)pyrrole-3-carboxylate Openeye Name: ethyl 4-[5-chloro-2-(3-methylbut-2-enylamino)phenyl]sulfonyl-1-(3-methylbut-2-enyl)pyrrole-3-carboxylate CAS Name: 4-[5-chloro-2-(3-methylbut-2-enylamino)phenyl]sulfonyl-1-(3-methylbut-2-enyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-chloro-2-(3-methylbut-2-enylamino)phenyl]sulfonyl-1-(3-methylbut-2-enyl)pyrrole-3-carboxylate Traditional Name: 4-[5-chloro-2-(3-methylbut-2-enylamino)phenyl]sulfonyl-1-(3-methylbut-2-enyl)pyrrole-3-carboxylic acid ethyl ester Formula: C23H29ClN2O4S MolecularWeight: 465.00536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=C1S(=O)(=O)C2=C(C=CC(=C2)Cl)NCC=C(C)C)CC=C(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C=C1S(=O)(=O)C2=C(C=CC(=C2)Cl)NCC=C(C)C)CC=C(C)C

InChI

InChI=1S/C23H29ClN2O4S/c1-6-30-23(27)19-14-26(12-10-17(4)5)15-22(19)31(28,29)21-13-18(24)7-8-20(21)25-11-9-16(2)3/h7-10,13-15,25H,6,11-12H2,1-5H3