1,1-dimethyl-3-[[2-oxidanylidene-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiourea

Systemtic Name: 1,1-dimethyl-3-[[2-oxidanylidene-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiourea Openeye Name: 1,1-dimethyl-3-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]oxazolidin-5-yl]methyl]thiourea CAS Name: 1,1-dimethyl-3-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]-5-oxazolidinyl]methyl]thiourea IUPAC Name: 1,1-dimethyl-3-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiourea Traditional Name: 3-[[2-keto-3-[4-(1,4-thiazepan-4-yl)phenyl]oxazolidin-5-yl]methyl]-1,1-dimethyl-thiourea Formula: C18H26N4O2S2 MolecularWeight: 394.55464

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)NCC1CN(C(=O)O1)C2=CC=C(C=C2)N3CCCSCC3

Isomeric SMILES

CN(C)C(=S)NCC1CN(C(=O)O1)C2=CC=C(C=C2)N3CCCSCC3

InChI

InChI=1S/C18H26N4O2S2/c1-20(2)17(25)19-12-16-13-22(18(23)24-16)15-6-4-14(5-7-15)21-8-3-10-26-11-9-21/h4-7,16H,3,8-13H2,1-2H3,(H,19,25)