1-tert-butyl-3-[2-(4-chlorophenyl)sulfanylethyl]thiourea

Systemtic Name: 1-tert-butyl-3-[2-(4-chlorophenyl)sulfanylethyl]thiourea Openeye Name: 1-tert-butyl-3-[2-(4-chlorophenyl)sulfanylethyl]thiourea CAS Name: 1-tert-butyl-3-[2-[(4-chlorophenyl)thio]ethyl]thiourea IUPAC Name: 1-tert-butyl-3-[2-(4-chlorophenyl)sulfanylethyl]thiourea Traditional Name: 1-tert-butyl-3-[2-[(4-chlorophenyl)thio]ethyl]thiourea Formula: C13H19ClN2S2 MolecularWeight: 302.88636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C)NC(=S)NCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H19ClN2S2/c1-13(2,3)16-12(17)15-8-9-18-11-6-4-10(14)5-7-11/h4-7H,8-9H2,1-3H3,(H2,15,16,17)