1-[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-3-[3-(methylthio)propyl]thiourea Formula: C16H25N3OS3 MolecularWeight: 371.5842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCCCSC

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCCCSC

InChI

InChI=1S/C16H25N3OS3/c1-3-11-5-6-13-12(9-11)10-14(23-13)15(20)18-19-16(21)17-7-4-8-22-2/h10-11H,3-9H2,1-2H3,(H,18,20)(H2,17,19,21)/t11-/m0/s1