methyl 3-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]butanoate Openeye Name: methyl 3-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]butanoate CAS Name: 3-methyl-2-[[4-[(2-methyl-1-benzimidazolyl)methyl]phenyl]sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]butanoate Traditional Name: 3-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]butyric acid methyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)S(=O)(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)S(=O)(=O)NC(C(C)C)C(=O)OC

InChI

InChI=1S/C21H25N3O4S/c1-14(2)20(21(25)28-4)23-29(26,27)17-11-9-16(10-12-17)13-24-15(3)22-18-7-5-6-8-19(18)24/h5-12,14,20,23H,13H2,1-4H3