1-(1,3-benzodioxol-5-ylmethyl)-3-quinazolin-6-yl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-quinazolin-6-yl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-quinazolin-6-yl-thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(6-quinazolinyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-quinazolin-6-ylthiourea Traditional Name: 1-piperonyl-3-quinazolin-6-yl-thiourea Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC4=CN=CN=C4C=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC4=CN=CN=C4C=C3

InChI

InChI=1S/C17H14N4O2S/c24-17(19-7-11-1-4-15-16(5-11)23-10-22-15)21-13-2-3-14-12(6-13)8-18-9-20-14/h1-6,8-9H,7,10H2,(H2,19,21,24)