2-(2-methylphenoxy)ethyl N'-[(2S)-butan-2-yl]carbamimidothioate

Systemtic Name: 2-(2-methylphenoxy)ethyl N'-[(2S)-butan-2-yl]carbamimidothioate Openeye Name: 2-[2-(2-methylphenoxy)ethyl]-3-[(1S)-1-methylpropyl]isothiourea CAS Name: N'-[(2S)-butan-2-yl]carbamimidothioic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl N'-[(2S)-butan-2-yl]carbamimidothioate Traditional Name: 2-[2-(2-methylphenoxy)ethyl]-3-[(1S)-1-methylpropyl]isothiourea Formula: C14H22N2OS MolecularWeight: 266.40228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N=C(N)SCCOC1=CC=CC=C1C

Isomeric SMILES

CC[C@H](C)N=C(N)SCCOC1=CC=CC=C1C

InChI

InChI=1S/C14H22N2OS/c1-4-12(3)16-14(15)18-10-9-17-13-8-6-5-7-11(13)2/h5-8,12H,4,9-10H2,1-3H3,(H2,15,16)/t12-/m0/s1