2-[(5-chloranyl-2-methoxy-phenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)propanamide

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)propanamide Openeye Name: 2-(5-chloro-2-methoxy-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)propanamide CAS Name: 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]propanamide IUPAC Name: 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)propanamide Traditional Name: 2-(5-chloro-N-mesyl-2-methoxy-anilino)-N-(3-pyrrolidinopropyl)propionamide Formula: C18H28ClN3O4S MolecularWeight: 417.95062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCN1CCCC1)N(C2=C(C=CC(=C2)Cl)OC)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCCCN1CCCC1)N(C2=C(C=CC(=C2)Cl)OC)S(=O)(=O)C

InChI

InChI=1S/C18H28ClN3O4S/c1-14(18(23)20-9-6-12-21-10-4-5-11-21)22(27(3,24)25)16-13-15(19)7-8-17(16)26-2/h7-8,13-14H,4-6,9-12H2,1-3H3,(H,20,23)