1-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]-3-methyl-urea

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]-3-methyl-urea Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-quinazolin-2-yl]-3-methyl-urea CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-2-quinazolinyl]-3-methylurea IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloroquinazolin-2-yl]-3-methylurea Traditional Name: 1-[6-chloro-4-(piperonylamino)quinazolin-2-yl]-3-methyl-urea Formula: C18H16ClN5O3 MolecularWeight: 385.80434

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=NC2=C(C=C(C=C2)Cl)C(=N1)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CNC(=O)NC1=NC2=C(C=C(C=C2)Cl)C(=N1)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16ClN5O3/c1-20-18(25)24-17-22-13-4-3-11(19)7-12(13)16(23-17)21-8-10-2-5-14-15(6-10)27-9-26-14/h2-7H,8-9H2,1H3,(H3,20,21,22,23,24,25)