N-[[1-(dimethylamino)cycloheptyl]methyl]-3-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-(p-tolylsulfonylamino)propanamide CAS Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-(tosylamino)propionamide Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2(CCCCCC2)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2(CCCCCC2)N(C)C

InChI

InChI=1S/C20H33N3O3S/c1-17-8-10-18(11-9-17)27(25,26)22-15-12-19(24)21-16-20(23(2)3)13-6-4-5-7-14-20/h8-11,22H,4-7,12-16H2,1-3H3,(H,21,24)