1-(6-cyano-1,3-benzothiazol-2-yl)-3-(1-phenylethyl)urea

Systemtic Name: 1-(6-cyano-1,3-benzothiazol-2-yl)-3-(1-phenylethyl)urea Openeye Name: 1-(6-cyano-1,3-benzothiazol-2-yl)-3-(1-phenylethyl)urea CAS Name: 1-(6-cyano-1,3-benzothiazol-2-yl)-3-(1-phenylethyl)urea IUPAC Name: 1-(6-cyano-1,3-benzothiazol-2-yl)-3-(1-phenylethyl)urea Traditional Name: 1-(6-cyano-1,3-benzothiazol-2-yl)-3-(1-phenylethyl)urea Formula: C17H14N4OS MolecularWeight: 322.38426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)NC2=NC3=C(S2)C=C(C=C3)C#N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)NC2=NC3=C(S2)C=C(C=C3)C#N

InChI

InChI=1S/C17H14N4OS/c1-11(13-5-3-2-4-6-13)19-16(22)21-17-20-14-8-7-12(10-18)9-15(14)23-17/h2-9,11H,1H3,(H2,19,20,21,22)