1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)thiourea

Systemtic Name: 1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)thiourea Openeye Name: 1-phenyl-3-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)thiourea CAS Name: 1-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]-3-phenylthiourea IUPAC Name: 1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)thiourea Traditional Name: 1-phenyl-3-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)thiourea Formula: C16H17N3OS2 MolecularWeight: 331.45568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C16H17N3OS2/c20-15(13-10-22-14-9-5-4-8-12(13)14)18-19-16(21)17-11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,18,20)(H2,17,19,21)