4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-N,3-dimethyl-butanethioamide

Systemtic Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-N,3-dimethyl-butanethioamide Openeye Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-N,3-dimethyl-butanethioamide CAS Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]-N,3-dimethylbutanethioamide IUPAC Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]-N,3-dimethylbutanethioamide Traditional Name: 4-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]-N,3-dimethyl-thiobutyramide Formula: C23H27BrN2OS MolecularWeight: 459.44228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CC(C)CC(=S)NC

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CC(C)CC(=S)NC

InChI

InChI=1S/C23H27BrN2OS/c1-15(12-23(28)25-3)11-20-16(2)26(14-17-5-7-18(24)8-6-17)22-10-9-19(27-4)13-21(20)22/h5-10,13,15H,11-12,14H2,1-4H3,(H,25,28)