(3-morpholin-4-ylsulfonylphenyl)methyl N'-propylcarbamimidothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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