N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[5-[(4-bromophenyl)methyl]thiazol-2-yl]-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[5-[(4-bromophenyl)methyl]-2-thiazolyl]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[5-(4-bromobenzyl)thiazol-2-yl]-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H21BrN2OS2 MolecularWeight: 461.43824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC=C2C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Br

Isomeric SMILES

CCC1CCC2=C(C1)SC=C2C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN2OS2/c1-2-13-5-8-17-18(12-26-19(17)10-13)20(25)24-21-23-11-16(27-21)9-14-3-6-15(22)7-4-14/h3-4,6-7,11-13H,2,5,8-10H2,1H3,(H,23,24,25)