N-[[(2S)-3-hexoxy-2-oxidanyl-propyl]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: N-[[(2S)-3-hexoxy-2-oxidanyl-propyl]carbamothioyl]-4-methoxy-benzamide Openeye Name: N-[[(2S)-3-hexoxy-2-hydroxy-propyl]carbamothioyl]-4-methoxy-benzamide CAS Name: N-[[[(2S)-3-hexoxy-2-hydroxypropyl]amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: N-[[(2S)-3-hexoxy-2-hydroxypropyl]carbamothioyl]-4-methoxybenzamide Traditional Name: N-[[(2S)-3-hexoxy-2-hydroxy-propyl]thiocarbamoyl]-4-methoxy-benzamide Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC(CNC(=S)NC(=O)C1=CC=C(C=C1)OC)O

Isomeric SMILES

CCCCCCOC[C@H](CNC(=S)NC(=O)C1=CC=C(C=C1)OC)O

InChI

InChI=1S/C18H28N2O4S/c1-3-4-5-6-11-24-13-15(21)12-19-18(25)20-17(22)14-7-9-16(23-2)10-8-14/h7-10,15,21H,3-6,11-13H2,1-2H3,(H2,19,20,22,25)/t15-/m0/s1