5-methyl-2-phenyl-4-[[4-(6-propan-2-ylquinolin-8-yl)-1,4-diazepan-1-yl]methyl]-1,3-thiazole

Systemtic Name: 5-methyl-2-phenyl-4-[[4-(6-propan-2-ylquinolin-8-yl)-1,4-diazepan-1-yl]methyl]-1,3-thiazole Openeye Name: 4-[[4-(6-isopropyl-8-quinolyl)-1,4-diazepan-1-yl]methyl]-5-methyl-2-phenyl-thiazole CAS Name: 5-methyl-2-phenyl-4-[[4-(6-propan-2-yl-8-quinolinyl)-1,4-diazepan-1-yl]methyl]thiazole IUPAC Name: 5-methyl-2-phenyl-4-[[4-(6-propan-2-ylquinolin-8-yl)-1,4-diazepan-1-yl]methyl]-1,3-thiazole Traditional Name: 4-[[4-(6-isopropyl-8-quinolyl)-1,4-diazepan-1-yl]methyl]-5-methyl-2-phenyl-thiazole Formula: C28H32N4S MolecularWeight: 456.64548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=CC=C2)CN3CCCN(CC3)C4=C5C(=CC(=C4)C(C)C)C=CC=N5

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CC=C2)CN3CCCN(CC3)C4=C5C(=CC(=C4)C(C)C)C=CC=N5

InChI

InChI=1S/C28H32N4S/c1-20(2)24-17-23-11-7-12-29-27(23)26(18-24)32-14-8-13-31(15-16-32)19-25-21(3)33-28(30-25)22-9-5-4-6-10-22/h4-7,9-12,17-18,20H,8,13-16,19H2,1-3H3