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

Systemtic Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-3-(2-furylmethyl)thiourea CAS Name: 1-[[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[[(5S)-5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-3-(2-furfuryl)thiourea Formula: C17H21N3O2S2 MolecularWeight: 363.49754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCC3=CC=CO3

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCC3=CC=CO3

InChI

InChI=1S/C17H21N3O2S2/c1-2-11-5-6-14-12(8-11)9-15(24-14)16(21)19-20-17(23)18-10-13-4-3-7-22-13/h3-4,7,9,11H,2,5-6,8,10H2,1H3,(H,19,21)(H2,18,20,23)/t11-/m0/s1