5-cyclopropyl-2-[[methyl-[(4-morpholin-4-ylphenyl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 5-cyclopropyl-2-[[methyl-[(4-morpholin-4-ylphenyl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-cyclopropyl-2-[[methyl-[(4-morpholinophenyl)methyl]amino]methyl]-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-2-[[methyl-[[4-(4-morpholinyl)phenyl]methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-cyclopropyl-2-[[methyl-[(4-morpholin-4-ylphenyl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-cyclopropyl-2-[[methyl-(4-morpholinobenzyl)amino]methyl]-1,2,4-triazole-3-thione Formula: C21H29N5OS MolecularWeight: 399.55286

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCOCC2)CN3C(=S)N(C(=N3)C4CC4)CC=C

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCOCC2)CN3C(=S)N(C(=N3)C4CC4)CC=C

InChI

InChI=1S/C21H29N5OS/c1-3-10-25-20(18-6-7-18)22-26(21(25)28)16-23(2)15-17-4-8-19(9-5-17)24-11-13-27-14-12-24/h3-5,8-9,18H,1,6-7,10-16H2,2H3