N-(benzimidazol-1-yl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(benzimidazol-1-yl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide Openeye Name: N-(benzimidazol-1-yl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide CAS Name: N-(1-benzimidazolyl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide IUPAC Name: N-(benzimidazol-1-yl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide Traditional Name: N-(benzimidazol-1-yl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propionamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCC(=O)NN2C=NC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCC(=O)NN2C=NC3=CC=CC=C32)C)C

InChI

InChI=1S/C21H26N4O3S/c1-13-14(2)16(4)21(17(5)15(13)3)29(27,28)23-11-10-20(26)24-25-12-22-18-8-6-7-9-19(18)25/h6-9,12,23H,10-11H2,1-5H3,(H,24,26)