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

Systemtic Name: [4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)methanone Openeye Name: (2-isopropyl-4-methyl-thiazol-5-yl)-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-propan-2-yl-5-thiazolyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)methanone Traditional Name: (2-isopropyl-4-methyl-thiazol-5-yl)-(4-tosyl-1,4-diazepan-1-yl)methanone Formula: C20H27N3O3S2 MolecularWeight: 421.57668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=C(N=C(S3)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=C(N=C(S3)C(C)C)C

InChI

InChI=1S/C20H27N3O3S2/c1-14(2)19-21-16(4)18(27-19)20(24)22-10-5-11-23(13-12-22)28(25,26)17-8-6-15(3)7-9-17/h6-9,14H,5,10-13H2,1-4H3