1-[(2S)-butan-2-yl]-3-phenethyl-thiourea

Systemtic Name: 1-[(2S)-butan-2-yl]-3-phenethyl-thiourea Openeye Name: 1-[(1S)-1-methylpropyl]-3-phenethyl-thiourea CAS Name: 1-[(2S)-butan-2-yl]-3-phenethylthiourea IUPAC Name: 1-[(2S)-butan-2-yl]-3-phenethylthiourea Traditional Name: 1-[(1S)-1-methylpropyl]-3-phenethyl-thiourea Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)NCCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)NC(=S)NCCC1=CC=CC=C1

InChI

InChI=1S/C13H20N2S/c1-3-11(2)15-13(16)14-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3,(H2,14,15,16)/t11-/m0/s1