1-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylamino]-3-(4-chlorophenyl)urea

Systemtic Name: 1-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylamino]-3-(4-chlorophenyl)urea Openeye Name: 1-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]amino]-3-(4-chlorophenyl)urea CAS Name: 1-[[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]amino]-3-(4-chlorophenyl)urea IUPAC Name: 1-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]amino]-3-(4-chlorophenyl)urea Traditional Name: 1-[[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]amino]-3-(4-chlorophenyl)urea Formula: C22H17ClN4O2S2 MolecularWeight: 468.97898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NNC(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NNC(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN4O2S2/c23-16-9-11-17(12-10-16)24-21(29)27-26-20(28)15-7-5-14(6-8-15)13-30-22-25-18-3-1-2-4-19(18)31-22/h1-12H,13H2,(H,26,28)(H2,24,27,29)