(3-morpholin-4-ylsulfonylphenyl)methyl N'-propan-2-ylcarbamimidothioate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl N'-propan-2-ylcarbamimidothioate Openeye Name: 3-isopropyl-2-[(3-morpholinosulfonylphenyl)methyl]isothiourea CAS Name: N'-propan-2-ylcarbamimidothioic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl N'-propan-2-ylcarbamimidothioate Traditional Name: 3-isopropyl-2-(3-morpholinosulfonylbenzyl)isothiourea Formula: C15H23N3O3S2 MolecularWeight: 357.49142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(N)SCC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)N=C(N)SCC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C15H23N3O3S2/c1-12(2)17-15(16)22-11-13-4-3-5-14(10-13)23(19,20)18-6-8-21-9-7-18/h3-5,10,12H,6-9,11H2,1-2H3,(H2,16,17)