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

Systemtic Name: [4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-(2-phenyl-1,3-thiazol-5-yl)methanone Openeye Name: [4-(o-tolylmethyl)-1,4-diazepan-1-yl]-(2-phenylthiazol-5-yl)methanone CAS Name: [4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-(2-phenyl-5-thiazolyl)methanone IUPAC Name: [4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-(2-phenyl-1,3-thiazol-5-yl)methanone Traditional Name: [4-(2-methylbenzyl)-1,4-diazepan-1-yl]-(2-phenylthiazol-5-yl)methanone Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)C3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)C3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-18-8-5-6-11-20(18)17-25-12-7-13-26(15-14-25)23(27)21-16-24-22(28-21)19-9-3-2-4-10-19/h2-6,8-11,16H,7,12-15,17H2,1H3