3-chloranyl-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-3-chloro-N-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-3-chloro-N-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-3-chloro-N-methyl-benzothiophene-2-carboxamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H18ClN3OS/c1-24(21(26)20-19(22)17-9-5-6-10-18(17)27-20)12-16-11-23-25(14-16)13-15-7-3-2-4-8-15/h2-11,14H,12-13H2,1H3