1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-(2-oxolanylmethyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]thiourea IUPAC Name: 1-(oxolan-2-ylmethyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]thiourea Traditional Name: 1-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-(tetrahydrofurfuryl)thiourea Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1CC(OC1)CNC(=S)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H23N5O2S/c23-16-14-7-2-1-6-13(14)15(21-22-16)18-8-4-9-19-17(25)20-11-12-5-3-10-24-12/h1-2,6-7,12H,3-5,8-11H2,(H,18,21)(H,22,23)(H2,19,20,25)