1-[2-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)phenyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[2-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)phenyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[2-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[2-methyl-5-[[[3-(methylthio)propylamino]-sulfanylidenemethyl]amino]phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[2-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)phenyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[2-methyl-5-[3-(methylthio)propylthiocarbamoylamino]phenyl]-3-[3-(methylthio)propyl]thiourea Formula: C17H28N4S4 MolecularWeight: 416.69102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCCSC)NC(=S)NCCCSC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCCSC)NC(=S)NCCCSC

InChI

InChI=1S/C17H28N4S4/c1-13-6-7-14(20-16(22)18-8-4-10-24-2)12-15(13)21-17(23)19-9-5-11-25-3/h6-7,12H,4-5,8-11H2,1-3H3,(H2,18,20,22)(H2,19,21,23)