3-butyl-1-methyl-1-(phenylmethyl)thiourea

Systemtic Name: 3-butyl-1-methyl-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-butyl-1-methyl-thiourea CAS Name: 3-butyl-1-methyl-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-butyl-1-methylthiourea Traditional Name: 1-benzyl-3-butyl-1-methyl-thiourea Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)CC1=CC=CC=C1

Isomeric SMILES

CCCCNC(=S)N(C)CC1=CC=CC=C1

InChI

InChI=1S/C13H20N2S/c1-3-4-10-14-13(16)15(2)11-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16)