N-cyano-3-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]-N'-prop-2-ynyl-propanimidamide

Systemtic Name: N-cyano-3-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]-N'-prop-2-ynyl-propanimidamide Openeye Name: N-cyano-3-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]-N'-prop-2-ynyl-propanamidine CAS Name: N-cyano-3-[(5-methyl-1H-imidazol-4-yl)methylthio]-N'-prop-2-ynylpropanimidamide IUPAC Name: N-cyano-3-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]-N'-prop-2-ynylpropanimidamide Traditional Name: N-cyano-3-[(5-methyl-1H-imidazol-4-yl)methylthio]-N'-propargyl-propionamidine Formula: C12H15N5S MolecularWeight: 261.346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCC(=NCC#C)NC#N

Isomeric SMILES

CC1=C(N=CN1)CSCCC(=NCC#C)NC#N

InChI

InChI=1S/C12H15N5S/c1-3-5-14-12(15-8-13)4-6-18-7-11-10(2)16-9-17-11/h1,9H,4-7H2,2H3,(H,14,15)(H,16,17)