2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-(oxolan-2-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-(oxolan-2-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-(2-oxolanylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-(oxolan-2-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-(tetrahydrofurfuryl)-1,2,4-triazole-3-thione Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=S)N2CC3CCCO3)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=S)N2CC3CCCO3)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H28N4O2S/c1-29-21-10-8-19(9-11-21)23-25-28(24(31)27(23)16-22-7-4-14-30-22)17-26-13-12-18-5-2-3-6-20(18)15-26/h2-3,5-6,8-11,22H,4,7,12-17H2,1H3