3-[(2-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-N-sulfonyl-benzimidazole-5-carboxamide; 4-methylaniline

Systemtic Name: 3-[(2-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-N-sulfonyl-benzimidazole-5-carboxamide; 4-methylaniline Openeye Name: 3-[(2-chloro-4-phenyl-phenyl)methyl]-2-methyl-N-sulfonyl-benzimidazole-5-carboxamide; 4-methylaniline CAS Name: 3-[(2-chloro-4-phenylphenyl)methyl]-2-methyl-N-sulfonyl-5-benzimidazolecarboxamide; 4-methylaniline IUPAC Name: 3-[(2-chloro-4-phenylphenyl)methyl]-2-methyl-N-sulfonylbenzimidazole-5-carboxamide; 4-methylaniline Traditional Name: 3-(2-chloro-4-phenyl-benzyl)-2-methyl-N-sulfonyl-benzimidazole-5-carboxamide; p-toluidine Formula: C29H25ClN4O3S MolecularWeight: 545.0518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N.CC1=NC2=C(N1CC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)C=C(C=C2)C(=O)N=S(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)N.CC1=NC2=C(N1CC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)C=C(C=C2)C(=O)N=S(=O)=O

InChI

InChI=1S/C22H16ClN3O3S.C7H9N/c1-14-24-20-10-9-17(22(27)25-30(28)29)12-21(20)26(14)13-18-8-7-16(11-19(18)23)15-5-3-2-4-6-15;1-6-2-4-7(8)5-3-6/h2-12H,13H2,1H3;2-5H,8H2,1H3