1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-phenylsulfanyl-urea

Systemtic Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-phenylsulfanyl-urea Openeye Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-phenylsulfanyl-urea CAS Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(phenylthio)urea IUPAC Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-phenylsulfanylurea Traditional Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(phenylthio)urea Formula: C21H17N3OS2 MolecularWeight: 391.50918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)NSC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)NSC4=CC=CC=C4

InChI

InChI=1S/C21H17N3OS2/c1-14-7-12-18-19(13-14)26-20(23-18)15-8-10-16(11-9-15)22-21(25)24-27-17-5-3-2-4-6-17/h2-13H,1H3,(H2,22,24,25)