1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-phenethyl-urea

Systemtic Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-phenethyl-urea Openeye Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-phenethyl-urea CAS Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-phenethylurea IUPAC Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-phenethylurea Traditional Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-phenethyl-urea Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-28-19-13-12-18(17-10-6-3-7-11-17)21-20(19)25-23(29-21)26-22(27)24-15-14-16-8-4-2-5-9-16/h2-13H,14-15H2,1H3,(H2,24,25,26,27)