1-benzo[e][1,3]benzothiazol-2-yl-3-cyclohexyl-thiourea

Systemtic Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-cyclohexyl-thiourea Openeye Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-cyclohexyl-thiourea CAS Name: 1-(2-benzo[e][1,3]benzothiazolyl)-3-cyclohexylthiourea IUPAC Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-cyclohexylthiourea Traditional Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-cyclohexyl-thiourea Formula: C18H19N3S2 MolecularWeight: 341.49356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C18H19N3S2/c22-17(19-13-7-2-1-3-8-13)21-18-20-16-14-9-5-4-6-12(14)10-11-15(16)23-18/h4-6,9-11,13H,1-3,7-8H2,(H2,19,20,21,22)