3-[(4-bromophenyl)methyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide

Systemtic Name: 3-[(4-bromophenyl)methyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Openeye Name: 3-[(4-bromophenyl)methyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanamide CAS Name: 3-[(4-bromophenyl)methyl-methylamino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide IUPAC Name: 3-[(4-bromophenyl)methyl-methylamino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Traditional Name: 3-[(4-bromobenzyl)-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C20H22BrN3OS MolecularWeight: 432.37718

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=C(C2=C(S1)CCCC2)C#N)CC3=CC=C(C=C3)Br

Isomeric SMILES

CN(CCC(=O)NC1=C(C2=C(S1)CCCC2)C#N)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3OS/c1-24(13-14-6-8-15(21)9-7-14)11-10-19(25)23-20-17(12-22)16-4-2-3-5-18(16)26-20/h6-9H,2-5,10-11,13H2,1H3,(H,23,25)