1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-oxidanylidenequinoxalin-1-yl)ethanoylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-oxidanylidenequinoxalin-1-yl)ethanoylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[1-oxo-2-(2-oxo-1-quinoxalinyl)ethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]thiourea Traditional Name: 1-[[2-(2-ketoquinoxalin-1-yl)acetyl]amino]-3-piperonyl-thiourea Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC(=O)CN3C4=CC=CC=C4N=CC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC(=O)CN3C4=CC=CC=C4N=CC3=O

InChI

InChI=1S/C19H17N5O4S/c25-17(10-24-14-4-2-1-3-13(14)20-9-18(24)26)22-23-19(29)21-8-12-5-6-15-16(7-12)28-11-27-15/h1-7,9H,8,10-11H2,(H,22,25)(H2,21,23,29)