(2-azanyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl) N-[(3,4-dimethoxyphenyl)methyl]carbamate

Systemtic Name: (2-azanyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl) N-[(3,4-dimethoxyphenyl)methyl]carbamate Openeye Name: (2-amino-4,5,6,7-tetrahydrobenzothiophen-3-yl) N-[(3,4-dimethoxyphenyl)methyl]carbamate CAS Name: N-[(3,4-dimethoxyphenyl)methyl]carbamic acid (2-amino-4,5,6,7-tetrahydro-1-benzothiophen-3-yl) ester IUPAC Name: (2-amino-4,5,6,7-tetrahydro-1-benzothiophen-3-yl) N-[(3,4-dimethoxyphenyl)methyl]carbamate Traditional Name: N-veratrylcarbamic acid (2-amino-4,5,6,7-tetrahydrobenzothiophen-3-yl) ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)OC2=C(SC3=C2CCCC3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)OC2=C(SC3=C2CCCC3)N)OC

InChI

InChI=1S/C18H22N2O4S/c1-22-13-8-7-11(9-14(13)23-2)10-20-18(21)24-16-12-5-3-4-6-15(12)25-17(16)19/h7-9H,3-6,10,19H2,1-2H3,(H,20,21)