5-(azepan-1-yl)-2-cyclohexylsulfonyl-4-(4-methylphenyl)sulfonyl-1,3-thiazole

Systemtic Name: 5-(azepan-1-yl)-2-cyclohexylsulfonyl-4-(4-methylphenyl)sulfonyl-1,3-thiazole Openeye Name: 5-(azepan-1-yl)-2-cyclohexylsulfonyl-4-(p-tolylsulfonyl)thiazole CAS Name: 5-(1-azepanyl)-2-cyclohexylsulfonyl-4-(4-methylphenyl)sulfonylthiazole IUPAC Name: 5-(azepan-1-yl)-2-cyclohexylsulfonyl-4-(4-methylphenyl)sulfonyl-1,3-thiazole Traditional Name: 5-(azepan-1-yl)-2-cyclohexylsulfonyl-4-tosyl-thiazole Formula: C22H30N2O4S3 MolecularWeight: 482.6796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=N2)S(=O)(=O)C3CCCCC3)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=N2)S(=O)(=O)C3CCCCC3)N4CCCCCC4

InChI

InChI=1S/C22H30N2O4S3/c1-17-11-13-19(14-12-17)30(25,26)20-21(24-15-7-2-3-8-16-24)29-22(23-20)31(27,28)18-9-5-4-6-10-18/h11-14,18H,2-10,15-16H2,1H3