N-(2-bromanyl-4-methyl-phenyl)-1-methyl-4-(3-methylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-1-methyl-4-(3-methylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-1-methyl-4-[(3-methyl-1-piperidyl)sulfonyl]pyrrole-2-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-1-methyl-4-[(3-methyl-1-piperidinyl)sulfonyl]-2-pyrrolecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-1-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyrrole-2-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-1-methyl-4-(3-methylpiperidino)sulfonyl-pyrrole-2-carboxamide Formula: C19H24BrN3O3S MolecularWeight: 454.38116

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CN(C(=C2)C(=O)NC3=C(C=C(C=C3)C)Br)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CN(C(=C2)C(=O)NC3=C(C=C(C=C3)C)Br)C

InChI

InChI=1S/C19H24BrN3O3S/c1-13-6-7-17(16(20)9-13)21-19(24)18-10-15(12-22(18)3)27(25,26)23-8-4-5-14(2)11-23/h6-7,9-10,12,14H,4-5,8,11H2,1-3H3,(H,21,24)