3-[(2-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-1-pentylsulfonyl-indole-5-carboxamide

Systemtic Name: 3-[(2-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-1-pentylsulfonyl-indole-5-carboxamide Openeye Name: 3-[(2-chloro-4-phenyl-phenyl)methyl]-2-methyl-1-pentylsulfonyl-indole-5-carboxamide CAS Name: 3-[(2-chloro-4-phenylphenyl)methyl]-2-methyl-1-pentylsulfonyl-5-indolecarboxamide IUPAC Name: 3-[(2-chloro-4-phenylphenyl)methyl]-2-methyl-1-pentylsulfonylindole-5-carboxamide Traditional Name: 1-amylsulfonyl-3-(2-chloro-4-phenyl-benzyl)-2-methyl-indole-5-carboxamide Formula: C28H29ClN2O3S MolecularWeight: 509.05946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)N1C(=C(C2=C1C=CC(=C2)C(=O)N)CC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)C

Isomeric SMILES

CCCCCS(=O)(=O)N1C(=C(C2=C1C=CC(=C2)C(=O)N)CC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)C

InChI

InChI=1S/C28H29ClN2O3S/c1-3-4-8-15-35(33,34)31-19(2)24(25-17-23(28(30)32)13-14-27(25)31)16-22-12-11-21(18-26(22)29)20-9-6-5-7-10-20/h5-7,9-14,17-18H,3-4,8,15-16H2,1-2H3,(H2,30,32)