N-methyl-3-(propan-2-ylamino)-N-(1-pyridin-3-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-methyl-3-(propan-2-ylamino)-N-(1-pyridin-3-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-(isopropylamino)-N-methyl-N-[1-(3-pyridyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-methyl-3-(propan-2-ylamino)-N-[1-(3-pyridinyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-methyl-3-(propan-2-ylamino)-N-(1-pyridin-3-ylethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-(isopropylamino)-N-methyl-N-[1-(3-pyridyl)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC(=CC(=C1)C(=O)N(C)C(C)C2=CN=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)NC1=CC(=CC(=C1)C(=O)N(C)C(C)C2=CN=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H30N4O3S/c1-16(2)24-20-12-19(13-21(14-20)30(28,29)26-10-5-6-11-26)22(27)25(4)17(3)18-8-7-9-23-15-18/h7-9,12-17,24H,5-6,10-11H2,1-4H3