1-(3-methylbutyl)-3-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[[4-(methylsulfonylmethyl)benzoyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[[4-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[4-(methylsulfonylmethyl)benzoyl]amino]thiourea Traditional Name: 1-isoamyl-3-[[4-(mesylmethyl)benzoyl]amino]thiourea Formula: C15H23N3O3S2 MolecularWeight: 357.49142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CC=C(C=C1)CS(=O)(=O)C

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CC=C(C=C1)CS(=O)(=O)C

InChI

InChI=1S/C15H23N3O3S2/c1-11(2)8-9-16-15(22)18-17-14(19)13-6-4-12(5-7-13)10-23(3,20)21/h4-7,11H,8-10H2,1-3H3,(H,17,19)(H2,16,18,22)