1-methyl-3-[3-(3-sulfanyl-2H-1,2,3,4-tetrazol-1-yl)phenyl]urea

Systemtic Name: 1-methyl-3-[3-(3-sulfanyl-2H-1,2,3,4-tetrazol-1-yl)phenyl]urea Openeye Name: 1-methyl-3-[3-(3-sulfanyl-2H-tetrazol-1-yl)phenyl]urea CAS Name: 1-[3-(3-mercapto-2H-tetrazol-1-yl)phenyl]-3-methylurea IUPAC Name: 1-methyl-3-[3-(3-sulfanyl-2H-tetrazol-1-yl)phenyl]urea Traditional Name: 1-[3-(3-mercapto-2H-tetrazol-1-yl)phenyl]-3-methyl-urea Formula: C9H12N6OS MolecularWeight: 252.29618

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=CC(=C1)N2C=NN(N2)S

Isomeric SMILES

CNC(=O)NC1=CC=CC(=C1)N2C=NN(N2)S

InChI

InChI=1S/C9H12N6OS/c1-10-9(16)12-7-3-2-4-8(5-7)14-6-11-15(17)13-14/h2-6,13,17H,1H3,(H2,10,12,16)