cyclohexyl sulfamate; N-methyl-1-phenyl-N-(thiophen-3-ylmethyl)propan-2-amine

Systemtic Name: cyclohexyl sulfamate; N-methyl-1-phenyl-N-(thiophen-3-ylmethyl)propan-2-amine Openeye Name: cyclohexyl sulfamate; N-methyl-1-phenyl-N-(3-thienylmethyl)propan-2-amine CAS Name: N-methyl-1-phenyl-N-(3-thiophenylmethyl)-2-propanamine; sulfamic acid cyclohexyl ester IUPAC Name: cyclohexyl sulfamate; N-methyl-1-phenyl-N-(thiophen-3-ylmethyl)propan-2-amine Traditional Name: methyl-(1-methyl-2-phenyl-ethyl)-(3-thenyl)amine; sulfamic acid cyclohexyl ester Formula: C21H32N2O3S2 MolecularWeight: 424.62038

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)N(C)CC2=CSC=C2.C1CCC(CC1)OS(=O)(=O)N

Isomeric SMILES

CC(CC1=CC=CC=C1)N(C)CC2=CSC=C2.C1CCC(CC1)OS(=O)(=O)N

InChI

InChI=1S/C15H19NS.C6H13NO3S/c1-13(10-14-6-4-3-5-7-14)16(2)11-15-8-9-17-12-15;7-11(8,9)10-6-4-2-1-3-5-6/h3-9,12-13H,10-11H2,1-2H3;6H,1-5H2,(H2,7,8,9)