N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-[(4-methoxyphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C21H20N4O3S/c1-27-14-6-8-15(9-7-14)28-13-25-11-10-18(24-25)20(26)23-21-17(12-22)16-4-2-3-5-19(16)29-21/h6-11H,2-5,13H2,1H3,(H,23,26)