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

Systemtic Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-phenyl-thiourea Openeye Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-phenyl-thiourea CAS Name: 1-(2-benzo[e][1,3]benzothiazolyl)-3-phenylthiourea IUPAC Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-phenylthiourea Traditional Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-phenyl-thiourea Formula: C18H13N3S2 MolecularWeight: 335.44592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C18H13N3S2/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/h1-11H,(H2,19,20,21,22)