1-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]-3-cyclohexyl-thiourea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]-3-cyclohexyl-thiourea Openeye Name: 1-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-3-cyclohexyl-thiourea CAS Name: 1-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-3-cyclohexylthiourea IUPAC Name: 1-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-3-cyclohexylthiourea Traditional Name: 1-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-3-cyclohexyl-thiourea Formula: C17H18N4S2 MolecularWeight: 342.48162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC=C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CCC(CC1)NC(=S)NC=C(C#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N4S2/c18-10-12(16-21-14-8-4-5-9-15(14)23-16)11-19-17(22)20-13-6-2-1-3-7-13/h4-5,8-9,11,13H,1-3,6-7H2,(H2,19,20,22)