[4-(1-adamantylcarbonylamino)-3-methyl-phenyl] thiocyanate

Systemtic Name: [4-(1-adamantylcarbonylamino)-3-methyl-phenyl] thiocyanate Openeye Name: [4-(adamantane-1-carbonylamino)-3-methyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[1-adamantyl(oxo)methyl]amino]-3-methylphenyl] ester IUPAC Name: [4-(adamantane-1-carbonylamino)-3-methylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-(adamantane-1-carbonylamino)-3-methyl-phenyl] ester Formula: C19H22N2OS MolecularWeight: 326.45578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H22N2OS/c1-12-4-16(23-11-20)2-3-17(12)21-18(22)19-8-13-5-14(9-19)7-15(6-13)10-19/h2-4,13-15H,5-10H2,1H3,(H,21,22)