N-[(E)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(E)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(E)-[5-(1-piperidyl)-2-thienyl]methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(E)-[5-(1-piperidinyl)-2-thiophenyl]methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(E)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(E)-(5-piperidino-2-thienyl)methyleneamino]-piperonylamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(S2)C=NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(S2)/C=N/NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19N3O3S/c22-18(13-4-6-15-16(10-13)24-12-23-15)20-19-11-14-5-7-17(25-14)21-8-2-1-3-9-21/h4-7,10-11H,1-3,8-9,12H2,(H,20,22)/b19-11+