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

Systemtic Name: 1-butyl-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea Openeye Name: 1-butyl-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea CAS Name: 1-butyl-3-[2-[(4-chlorophenyl)thio]phenyl]thiourea IUPAC Name: 1-butyl-3-[2-(4-chlorophenyl)sulfanylphenyl]thiourea Traditional Name: 1-butyl-3-[2-[(4-chlorophenyl)thio]phenyl]thiourea Formula: C17H19ClN2S2 MolecularWeight: 350.92916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=CC=C1SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCNC(=S)NC1=CC=CC=C1SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H19ClN2S2/c1-2-3-12-19-17(21)20-15-6-4-5-7-16(15)22-14-10-8-13(18)9-11-14/h4-11H,2-3,12H2,1H3,(H2,19,20,21)