N-[2-[3-[(4-bromophenyl)methylsulfanyl]indol-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[3-[(4-bromophenyl)methylsulfanyl]indol-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[3-[(4-bromophenyl)methylsulfanyl]indol-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[3-[(4-bromophenyl)methylthio]-1-indolyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[3-[(4-bromophenyl)methylsulfanyl]indol-1-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[3-[(4-bromobenzyl)thio]indol-1-yl]ethyl]thiophene-2-carboxamide Formula: C22H19BrN2OS2 MolecularWeight: 471.43306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=CS3)SCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=CS3)SCC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN2OS2/c23-17-9-7-16(8-10-17)15-28-21-14-25(19-5-2-1-4-18(19)21)12-11-24-22(26)20-6-3-13-27-20/h1-10,13-14H,11-12,15H2,(H,24,26)