1-butyl-4-(4-isothiocyanatocyclohexyl)cyclohexane

Systemtic Name: 1-butyl-4-(4-isothiocyanatocyclohexyl)cyclohexane Openeye Name: 1-butyl-4-(4-isothiocyanatocyclohexyl)cyclohexane CAS Name: 1-butyl-4-(4-isothiocyanatocyclohexyl)cyclohexane IUPAC Name: 1-butyl-4-(4-isothiocyanatocyclohexyl)cyclohexane Traditional Name: 1-butyl-4-(4-isothiocyanatocyclohexyl)cyclohexane Formula: C17H29NS MolecularWeight: 279.48386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2CCC(CC2)N=C=S

Isomeric SMILES

CCCCC1CCC(CC1)C2CCC(CC2)N=C=S

InChI

InChI=1S/C17H29NS/c1-2-3-4-14-5-7-15(8-6-14)16-9-11-17(12-10-16)18-13-19/h14-17H,2-12H2,1H3