2-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydroquinazoline-4-thione

Systemtic Name: 2-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydroquinazoline-4-thione Openeye Name: 2-(4-methoxyphenyl)-1-(3-pyridylmethyl)-5,6,7,8-tetrahydroquinazoline-4-thione CAS Name: 2-(4-methoxyphenyl)-1-(3-pyridinylmethyl)-5,6,7,8-tetrahydroquinazoline-4-thione IUPAC Name: 2-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydroquinazoline-4-thione Traditional Name: 2-(4-methoxyphenyl)-1-(3-pyridylmethyl)-5,6,7,8-tetrahydroquinazoline-4-thione Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=S)C3=C(N2CC4=CN=CC=C4)CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=S)C3=C(N2CC4=CN=CC=C4)CCCC3

InChI

InChI=1S/C21H21N3OS/c1-25-17-10-8-16(9-11-17)20-23-21(26)18-6-2-3-7-19(18)24(20)14-15-5-4-12-22-13-15/h4-5,8-13H,2-3,6-7,14H2,1H3