O-(6H-indolo[2,3-b]quinoxalin-2-yl) N-(phenylmethyl)-N-propyl-carbamothioate

Systemtic Name: O-(6H-indolo[2,3-b]quinoxalin-2-yl) N-(phenylmethyl)-N-propyl-carbamothioate Openeye Name: O-(6H-indolo[2,3-b]quinoxalin-2-yl) N-benzyl-N-propyl-carbamothioate CAS Name: N-(phenylmethyl)-N-propylcarbamothioic acid O-(6H-indolo[2,3-b]quinoxalin-2-yl) ester IUPAC Name: O-(6H-indolo[2,3-b]quinoxalin-2-yl) N-benzyl-N-propylcarbamothioate Traditional Name: N-benzyl-N-propyl-thiocarbamic acid O-(6H-indolo[2,3-b]quinoxalin-2-yl) ester Formula: C25H22N4OS MolecularWeight: 426.53338

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=S)OC2=CC3=C(C=C2)N=C4C(=N3)C5=CC=CC=C5N4

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=S)OC2=CC3=C(C=C2)N=C4C(=N3)C5=CC=CC=C5N4

InChI

InChI=1S/C25H22N4OS/c1-2-14-29(16-17-8-4-3-5-9-17)25(31)30-18-12-13-21-22(15-18)26-23-19-10-6-7-11-20(19)27-24(23)28-21/h3-13,15H,2,14,16H2,1H3,(H,27,28)