N,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N,5-dimethyl-N-[(1-methyl-4-pyrazolyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N(C)CC3=CN(N=C3)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N(C)CC3=CN(N=C3)C

InChI

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