4-azanylbenzenethiol; N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamine

Systemtic Name: 4-azanylbenzenethiol; N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamine Openeye Name: 4-aminobenzenethiol; N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamine CAS Name: 4-aminobenzenethiol; N-[(3,4-dimethoxyphenyl)methyl]-N-methylethanamine IUPAC Name: 4-aminobenzenethiol; N-[(3,4-dimethoxyphenyl)methyl]-N-methylethanamine Traditional Name: 4-aminobenzenethiol; ethyl-methyl-veratryl-amine Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)CC1=CC(=C(C=C1)OC)OC.C1=CC(=CC=C1N)S

Isomeric SMILES

CCN(C)CC1=CC(=C(C=C1)OC)OC.C1=CC(=CC=C1N)S

InChI

InChI=1S/C12H19NO2.C6H7NS/c1-5-13(2)9-10-6-7-11(14-3)12(8-10)15-4;7-5-1-3-6(8)4-2-5/h6-8H,5,9H2,1-4H3;1-4,8H,7H2