3-chloranyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-6-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-6-methyl-benzothiophene-2-carboxamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)N4C(=CC(=N4)C)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)N4C(=CC(=N4)C)C)Cl

InChI

InChI=1S/C21H18ClN3OS/c1-12-4-9-17-18(10-12)27-20(19(17)22)21(26)23-15-5-7-16(8-6-15)25-14(3)11-13(2)24-25/h4-11H,1-3H3,(H,23,26)