3-chloranyl-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-6-methoxy-benzothiophene-2-carboxamide Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=C(C4=C(S3)C=C(C=C4)OC)Cl)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=C(C4=C(S3)C=C(C=C4)OC)Cl)C

InChI

InChI=1S/C23H22ClN3O2S/c1-13-7-5-6-8-16(13)12-27-15(3)21(14(2)26-27)25-23(28)22-20(24)18-10-9-17(29-4)11-19(18)30-22/h5-11H,12H2,1-4H3,(H,25,28)