N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-3-methoxy-2-naphthamide Formula: C20H16BrN3O2S MolecularWeight: 442.32894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC3=CC=NN3CC4=CC(=CS4)Br

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC3=CC=NN3CC4=CC(=CS4)Br

InChI

InChI=1S/C20H16BrN3O2S/c1-26-18-9-14-5-3-2-4-13(14)8-17(18)20(25)23-19-6-7-22-24(19)11-16-10-15(21)12-27-16/h2-10,12H,11H2,1H3,(H,23,25)