N-(2-aminophenyl)-4-[3-methyl-5-[(3-methylsulfonylpyrrolidin-1-yl)methyl]pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-methyl-5-[(3-methylsulfonylpyrrolidin-1-yl)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-methyl-5-[(3-methylsulfonylpyrrolidin-1-yl)methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-methyl-5-[(3-methylsulfonyl-1-pyrrolidinyl)methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-methyl-5-[(3-methylsulfonylpyrrolidin-1-yl)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[5-[(3-mesylpyrrolidino)methyl]-3-methyl-2-pyridyl]benzamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)CN2CCC(C2)S(=O)(=O)C)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CC1=C(N=CC(=C1)CN2CCC(C2)S(=O)(=O)C)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C25H28N4O3S/c1-17-13-18(15-29-12-11-21(16-29)33(2,31)32)14-27-24(17)19-7-9-20(10-8-19)25(30)28-23-6-4-3-5-22(23)26/h3-10,13-14,21H,11-12,15-16,26H2,1-2H3,(H,28,30)