1-(3-methylbutyl)-3-[[3-(methylsulfanylmethyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[[3-(methylsulfanylmethyl)phenyl]carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[[3-(methylsulfanylmethyl)benzoyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[[3-[(methylthio)methyl]phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[3-(methylsulfanylmethyl)benzoyl]amino]thiourea Traditional Name: 1-isoamyl-3-[[3-[(methylthio)methyl]benzoyl]amino]thiourea Formula: C15H23N3OS2 MolecularWeight: 325.49262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3OS2/c1-11(2)7-8-16-15(20)18-17-14(19)13-6-4-5-12(9-13)10-21-3/h4-6,9,11H,7-8,10H2,1-3H3,(H,17,19)(H2,16,18,20)