1,1-dibutyl-3-[(4-chlorophenyl)methyl]thiourea

Systemtic Name: 1,1-dibutyl-3-[(4-chlorophenyl)methyl]thiourea Openeye Name: 1,1-dibutyl-3-[(4-chlorophenyl)methyl]thiourea CAS Name: 1,1-dibutyl-3-[(4-chlorophenyl)methyl]thiourea IUPAC Name: 1,1-dibutyl-3-[(4-chlorophenyl)methyl]thiourea Traditional Name: 1,1-dibutyl-3-(4-chlorobenzyl)thiourea Formula: C16H25ClN2S MolecularWeight: 312.9011

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=S)NCC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCN(CCCC)C(=S)NCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H25ClN2S/c1-3-5-11-19(12-6-4-2)16(20)18-13-14-7-9-15(17)10-8-14/h7-10H,3-6,11-13H2,1-2H3,(H,18,20)