2-methyl-4-[[4-(phenylmethyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-methyl-4-[[4-(phenylmethyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazole Openeye Name: 4-[(4-benzylsulfonyl-1,4-diazepan-1-yl)methyl]-2-methyl-thiazole CAS Name: 2-methyl-4-[[4-(phenylmethyl)sulfonyl-1,4-diazepan-1-yl]methyl]thiazole IUPAC Name: 4-[(4-benzylsulfonyl-1,4-diazepan-1-yl)methyl]-2-methyl-1,3-thiazole Traditional Name: 4-[(4-benzylsulfonyl-1,4-diazepan-1-yl)methyl]-2-methyl-thiazole Formula: C17H23N3O2S2 MolecularWeight: 365.51342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N3O2S2/c1-15-18-17(13-23-15)12-19-8-5-9-20(11-10-19)24(21,22)14-16-6-3-2-4-7-16/h2-4,6-7,13H,5,8-12,14H2,1H3