2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-amino-N-piperonyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H18N2O3S/c18-16-15(11-3-1-2-4-14(11)23-16)17(20)19-8-10-5-6-12-13(7-10)22-9-21-12/h5-7H,1-4,8-9,18H2,(H,19,20)