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

Systemtic Name: 1-(4-nitrophenyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)thiourea Openeye Name: 1-(4-nitrophenyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)thiourea CAS Name: 1-(4-nitrophenyl)-3-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]thiourea IUPAC Name: 1-(4-nitrophenyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)thiourea Traditional Name: 1-(4-nitrophenyl)-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)thiourea Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3S2/c22-16(15-10-11-4-2-1-3-5-14(11)26-15)19-20-17(25)18-12-6-8-13(9-7-12)21(23)24/h6-10H,1-5H2,(H,19,22)(H2,18,20,25)