1-pentan-3-yl-3-(phenylmethyl)thiourea

Systemtic Name: 1-pentan-3-yl-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(1-ethylpropyl)thiourea CAS Name: 1-pentan-3-yl-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-pentan-3-ylthiourea Traditional Name: 1-benzyl-3-(1-ethylpropyl)thiourea Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=S)NCC1=CC=CC=C1

Isomeric SMILES

CCC(CC)NC(=S)NCC1=CC=CC=C1

InChI

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