1-butyl-3-[(3,4-dichlorophenyl)methyl]thiourea

Systemtic Name: 1-butyl-3-[(3,4-dichlorophenyl)methyl]thiourea Openeye Name: 1-butyl-3-[(3,4-dichlorophenyl)methyl]thiourea CAS Name: 1-butyl-3-[(3,4-dichlorophenyl)methyl]thiourea IUPAC Name: 1-butyl-3-[(3,4-dichlorophenyl)methyl]thiourea Traditional Name: 1-butyl-3-(3,4-dichlorobenzyl)thiourea Formula: C12H16Cl2N2S MolecularWeight: 291.23984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCNC(=S)NCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C12H16Cl2N2S/c1-2-3-6-15-12(17)16-8-9-4-5-10(13)11(14)7-9/h4-5,7H,2-3,6,8H2,1H3,(H2,15,16,17)