N,6-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N,6-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N,6-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N,6-dimethyl-N-[(1-methyl-4-pyrazolyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N,6-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N,6-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)N(C)CC3=CN(N=C3)C

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)N(C)CC3=CN(N=C3)C

InChI

InChI=1S/C16H21N3OS/c1-11-4-5-13-14(10-21-15(13)6-11)16(20)18(2)8-12-7-17-19(3)9-12/h7,9-11H,4-6,8H2,1-3H3