[7-methyl-4-(2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-(2-methyl-5-phenyl-1,3-thiazol-4-yl)methanone

Systemtic Name: [7-methyl-4-(2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-(2-methyl-5-phenyl-1,3-thiazol-4-yl)methanone Openeye Name: [7-methyl-4-(2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-(2-methyl-5-phenyl-thiazol-4-yl)methanone CAS Name: [7-methyl-4-(2-phenyl-4-pyrimidinyl)-1,4-diazepan-1-yl]-(2-methyl-5-phenyl-4-thiazolyl)methanone IUPAC Name: [7-methyl-4-(2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-(2-methyl-5-phenyl-1,3-thiazol-4-yl)methanone Traditional Name: [7-methyl-4-(2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-(2-methyl-5-phenyl-thiazol-4-yl)methanone Formula: C27H27N5OS MolecularWeight: 469.60118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CCN1C(=O)C2=C(SC(=N2)C)C3=CC=CC=C3)C4=NC(=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CCN(CCN1C(=O)C2=C(SC(=N2)C)C3=CC=CC=C3)C4=NC(=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5OS/c1-19-14-16-31(23-13-15-28-26(30-23)22-11-7-4-8-12-22)17-18-32(19)27(33)24-25(34-20(2)29-24)21-9-5-3-6-10-21/h3-13,15,19H,14,16-18H2,1-2H3