1-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-(2-thienylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-(2-thenyl)-9H-$b-carboline-3-carboxamide Formula: C24H17N3O3S MolecularWeight: 427.47508

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C4C(=CC(=N3)C(=O)NCC5=CC=CS5)C6=CC=CC=C6N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C4C(=CC(=N3)C(=O)NCC5=CC=CS5)C6=CC=CC=C6N4

InChI

InChI=1S/C24H17N3O3S/c28-24(25-12-15-4-3-9-31-15)19-11-17-16-5-1-2-6-18(16)26-23(17)22(27-19)14-7-8-20-21(10-14)30-13-29-20/h1-11,26H,12-13H2,(H,25,28)