3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]propanamide CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]propanamide IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[4-(isopropylcarbamoylamino)benzyl]propionamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

InChI

InChI=1S/C22H30N4O4S/c1-15(2)25-22(28)26-19-9-7-18(8-10-19)14-23-21(27)11-12-24-31(29,30)20-13-16(3)5-6-17(20)4/h5-10,13,15,24H,11-12,14H2,1-4H3,(H,23,27)(H2,25,26,28)