3-chloranyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-4-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-benzothiophene-2-carboxamide Formula: C18H20ClN3OS MolecularWeight: 361.8889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)NCCCN3C(=CC(=N3)C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)NCCCN3C(=CC(=N3)C)C

InChI

InChI=1S/C18H20ClN3OS/c1-11-6-4-7-14-15(11)16(19)17(24-14)18(23)20-8-5-9-22-13(3)10-12(2)21-22/h4,6-7,10H,5,8-9H2,1-3H3,(H,20,23)