N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H19ClN4O2S/c1-11-15(17(21)25(24-11)12-7-3-2-4-8-12)19(27)23-20-16(18(22)26)13-9-5-6-10-14(13)28-20/h2-4,7-8H,5-6,9-10H2,1H3,(H2,22,26)(H,23,27)