2-(cycloheptylamino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(cycloheptylamino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(cycloheptylamino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 2-(cycloheptylamino)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(cycloheptylamino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-(cycloheptylamino)-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)NC3CCCCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)NC3CCCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-16(21-17-8-4-2-3-5-9-17)20(24)22-18-10-12-19(13-11-18)27(25,26)23-14-6-7-15-23/h10-13,16-17,21H,2-9,14-15H2,1H3,(H,22,24)