2,7-dimethyl-3-methylsulfanyl-6H-1,2,4-triazepin-5-one

Systemtic Name: 2,7-dimethyl-3-methylsulfanyl-6H-1,2,4-triazepin-5-one Openeye Name: 2,7-dimethyl-3-methylsulfanyl-6H-1,2,4-triazepin-5-one CAS Name: 2,7-dimethyl-3-(methylthio)-6H-1,2,4-triazepin-5-one IUPAC Name: 2,7-dimethyl-3-methylsulfanyl-6H-1,2,4-triazepin-5-one Traditional Name: 2,7-dimethyl-3-(methylthio)-6H-1,2,4-triazepin-5-one Formula: C7H11N3OS MolecularWeight: 185.24674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=NC(=O)C1)SC)C

Isomeric SMILES

CC1=NN(C(=NC(=O)C1)SC)C

InChI

InChI=1S/C7H11N3OS/c1-5-4-6(11)8-7(12-3)10(2)9-5/h4H2,1-3H3