N-[(4-ethoxyphenyl)methyl]-4-methyl-5-[1-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,3-thiazol-2-amine

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-4-methyl-5-[1-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,3-thiazol-2-amine Openeye Name: N-[(4-ethoxyphenyl)methyl]-4-methyl-5-[1-(3-thienylmethyl)pyrazol-3-yl]thiazol-2-amine CAS Name: N-[(4-ethoxyphenyl)methyl]-4-methyl-5-[1-(3-thiophenylmethyl)-3-pyrazolyl]-2-thiazolamine IUPAC Name: N-[(4-ethoxyphenyl)methyl]-4-methyl-5-[1-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,3-thiazol-2-amine Traditional Name: (4-ethoxybenzyl)-[4-methyl-5-[1-(3-thenyl)pyrazol-3-yl]thiazol-2-yl]amine Formula: C21H22N4OS2 MolecularWeight: 410.55558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC2=NC(=C(S2)C3=NN(C=C3)CC4=CSC=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC2=NC(=C(S2)C3=NN(C=C3)CC4=CSC=C4)C

InChI

InChI=1S/C21H22N4OS2/c1-3-26-18-6-4-16(5-7-18)12-22-21-23-15(2)20(28-21)19-8-10-25(24-19)13-17-9-11-27-14-17/h4-11,14H,3,12-13H2,1-2H3,(H,22,23)