1-(1,3-benzothiazol-2-yl)-3-cyclooctyl-thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-cyclooctyl-thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-cyclooctyl-thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-cyclooctylthiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-cyclooctylthiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-cyclooctyl-thiourea Formula: C16H21N3S2 MolecularWeight: 319.48804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CCCC(CCC1)NC(=S)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H21N3S2/c20-15(17-12-8-4-2-1-3-5-9-12)19-16-18-13-10-6-7-11-14(13)21-16/h6-7,10-12H,1-5,8-9H2,(H2,17,18,19,20)