1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(phenylmethyl)urea

Systemtic Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)urea CAS Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)urea Traditional Name: 1-benzyl-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)urea Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H17N3OS/c1-11-8-14-15(9-12(11)2)22-17(19-14)20-16(21)18-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H2,18,19,20,21)