1-(2-phenylsulfanylethyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)thiourea

Systemtic Name: 1-(2-phenylsulfanylethyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)thiourea Openeye Name: 1-(2-phenylsulfanylethyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)thiourea CAS Name: 1-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-(2-phenylsulfanylethyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)thiourea Traditional Name: 1-[2-(phenylthio)ethyl]-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)thiourea Formula: C19H23N3OS3 MolecularWeight: 405.60042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=S)NCCSC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=S)NCCSC3=CC=CC=C3

InChI

InChI=1S/C19H23N3OS3/c23-18(17-13-14-7-3-1-6-10-16(14)26-17)21-22-19(24)20-11-12-25-15-8-4-2-5-9-15/h2,4-5,8-9,13H,1,3,6-7,10-12H2,(H,21,23)(H2,20,22,24)