N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-dimethylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,5-dimethyl-pyrazole-4-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N

InChI

InChI=1S/C22H24N4O2S/c1-13-18(14(2)26(25-13)12-15-8-4-3-5-9-15)21(28)24-22-19(20(23)27)16-10-6-7-11-17(16)29-22/h3-5,8-9H,6-7,10-12H2,1-2H3,(H2,23,27)(H,24,28)