4,5-dimethyl-3-(phenylsulfonyl)-1-(pyridin-3-ylmethyl)pyrrol-2-amine

Systemtic Name: 4,5-dimethyl-3-(phenylsulfonyl)-1-(pyridin-3-ylmethyl)pyrrol-2-amine Openeye Name: 3-(benzenesulfonyl)-4,5-dimethyl-1-(3-pyridylmethyl)pyrrol-2-amine CAS Name: 3-(benzenesulfonyl)-4,5-dimethyl-1-(3-pyridinylmethyl)-2-pyrrolamine IUPAC Name: 3-(benzenesulfonyl)-4,5-dimethyl-1-(pyridin-3-ylmethyl)pyrrol-2-amine Traditional Name: [3-besyl-4,5-dimethyl-1-(3-pyridylmethyl)pyrrol-2-yl]amine Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)N)CC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)N)CC3=CN=CC=C3)C

InChI

InChI=1S/C18H19N3O2S/c1-13-14(2)21(12-15-7-6-10-20-11-15)18(19)17(13)24(22,23)16-8-4-3-5-9-16/h3-11H,12,19H2,1-2H3