ethyl 4-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoate

Systemtic Name: ethyl 4-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoate Openeye Name: ethyl 4-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoate CAS Name: 4-methyl-2-[[4-[(2-methyl-1-benzimidazolyl)methyl]phenyl]sulfonylamino]pentanoic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoate Traditional Name: 4-methyl-2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]valeric acid ethyl ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C32)C

InChI

InChI=1S/C23H29N3O4S/c1-5-30-23(27)21(14-16(2)3)25-31(28,29)19-12-10-18(11-13-19)15-26-17(4)24-20-8-6-7-9-22(20)26/h6-13,16,21,25H,5,14-15H2,1-4H3