2-cyclopropyl-1-isocyanato-3,3-bis(methylsulfanyl)prop-2-en-1-one

Systemtic Name: 2-cyclopropyl-1-isocyanato-3,3-bis(methylsulfanyl)prop-2-en-1-one Openeye Name: 2-cyclopropyl-3,3-bis(methylsulfanyl)prop-2-enoyl isocyanate CAS Name: 2-cyclopropyl-1-isocyanato-3,3-bis(methylthio)-2-propen-1-one IUPAC Name: 2-cyclopropyl-3,3-bis(methylsulfanyl)prop-2-enoyl isocyanate Traditional Name: 2-cyclopropyl-1-isocyanato-3,3-bis(methylthio)prop-2-en-1-one Formula: C9H11NO2S2 MolecularWeight: 229.31914

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C1CC1)C(=O)N=C=O)SC

Isomeric SMILES

CSC(=C(C1CC1)C(=O)N=C=O)SC

InChI

InChI=1S/C9H11NO2S2/c1-13-9(14-2)7(6-3-4-6)8(12)10-5-11/h6H,3-4H2,1-2H3