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

Systemtic Name: 6-ethyl-N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-ethyl-N-[5-[(3-nitrophenyl)methyl]thiazol-2-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-ethyl-N-[5-[(3-nitrophenyl)methyl]-2-thiazolyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-ethyl-N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-ethyl-N-[5-(3-nitrobenzyl)thiazol-2-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC=C2C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1CCC2=C(C1)SC=C2C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O3S2/c1-2-13-6-7-17-18(12-28-19(17)10-13)20(25)23-21-22-11-16(29-21)9-14-4-3-5-15(8-14)24(26)27/h3-5,8,11-13H,2,6-7,9-10H2,1H3,(H,22,23,25)