N-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-yl-ethanamine

Systemtic Name: N-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-yl-ethanamine Openeye Name: N-[[5-(6-methoxy-2-naphthyl)-1H-pyrazol-4-yl]methyl]-1-(2-thienyl)ethanamine CAS Name: N-[[5-(6-methoxy-2-naphthalenyl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-ylethanamine IUPAC Name: N-[[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-ylethanamine Traditional Name: [5-(6-methoxy-2-naphthyl)-1H-pyrazol-4-yl]methyl-[1-(2-thienyl)ethyl]amine Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NCC2=C(NN=C2)C3=CC4=C(C=C3)C=C(C=C4)OC

Isomeric SMILES

CC(C1=CC=CS1)NCC2=C(NN=C2)C3=CC4=C(C=C3)C=C(C=C4)OC

InChI

InChI=1S/C21H21N3OS/c1-14(20-4-3-9-26-20)22-12-18-13-23-24-21(18)17-6-5-16-11-19(25-2)8-7-15(16)10-17/h3-11,13-14,22H,12H2,1-2H3,(H,23,24)