4-isothiocyanato-6-methyl-2-propyl-pyrimidine

Systemtic Name: 4-isothiocyanato-6-methyl-2-propyl-pyrimidine Openeye Name: 4-isothiocyanato-6-methyl-2-propyl-pyrimidine CAS Name: 4-isothiocyanato-6-methyl-2-propylpyrimidine IUPAC Name: 4-isothiocyanato-6-methyl-2-propylpyrimidine Traditional Name: 4-isothiocyanato-6-methyl-2-propyl-pyrimidine Formula: C9H11N3S MolecularWeight: 193.26874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=CC(=N1)N=C=S)C

Isomeric SMILES

CCCC1=NC(=CC(=N1)N=C=S)C

InChI

InChI=1S/C9H11N3S/c1-3-4-8-11-7(2)5-9(12-8)10-6-13/h5H,3-4H2,1-2H3