N-cyclopropyl-N-[(7-methyl-2-thiophen-2-yl-quinolin-3-yl)methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-cyclopropyl-N-[(7-methyl-2-thiophen-2-yl-quinolin-3-yl)methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-cyclopropyl-N-[[7-methyl-2-(2-thienyl)-3-quinolyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-cyclopropyl-N-[(7-methyl-2-thiophen-2-yl-3-quinolinyl)methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-cyclopropyl-N-[(7-methyl-2-thiophen-2-ylquinolin-3-yl)methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-cyclopropyl-N-[[7-methyl-2-(2-thienyl)-3-quinolyl]methyl]-piperonylamide Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=CC5=C(C=C4)OCO5)C6=CC=CS6

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=CC5=C(C=C4)OCO5)C6=CC=CS6

InChI

InChI=1S/C26H22N2O3S/c1-16-4-5-17-12-19(25(27-21(17)11-16)24-3-2-10-32-24)14-28(20-7-8-20)26(29)18-6-9-22-23(13-18)31-15-30-22/h2-6,9-13,20H,7-8,14-15H2,1H3