N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-[(3,4-dimethylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-[(3,4-dimethylphenyl)sulfonylamino]propanamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-[(3,4-dimethylphenyl)sulfonylamino]propanamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-[(3,4-dimethylphenyl)sulfonylamino]propanamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-[(3,4-dimethylphenyl)sulfonylamino]propanamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-3-[(3,4-dimethylphenyl)sulfonylamino]propionamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CC=CC=C2CN(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CC=CC=C2CN(C)C)C

InChI

InChI=1S/C21H29N3O3S/c1-16-9-10-20(13-17(16)2)28(26,27)23-12-11-21(25)22-14-18-7-5-6-8-19(18)15-24(3)4/h5-10,13,23H,11-12,14-15H2,1-4H3,(H,22,25)