3-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(2-oxidanylideneethyl)-1-prop-2-enyl-urea

Systemtic Name: 3-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(2-oxidanylideneethyl)-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-(6-chloro-1,3-benzothiazol-2-yl)-1-(2-oxoethyl)urea CAS Name: 3-(6-chloro-1,3-benzothiazol-2-yl)-1-(2-oxoethyl)-1-prop-2-enylurea IUPAC Name: 3-(6-chloro-1,3-benzothiazol-2-yl)-1-(2-oxoethyl)-1-prop-2-enylurea Traditional Name: 1-allyl-3-(6-chloro-1,3-benzothiazol-2-yl)-1-(2-ketoethyl)urea Formula: C13H12ClN3O2S MolecularWeight: 309.77128

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)Cl

Isomeric SMILES

C=CCN(CC=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3O2S/c1-2-5-17(6-7-18)13(19)16-12-15-10-4-3-9(14)8-11(10)20-12/h2-4,7-8H,1,5-6H2,(H,15,16,19)