1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]thiourea CAS Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]thiourea Traditional Name: 1-benzyl-3-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]thiourea Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H21N5OS/c25-18-16-10-5-4-9-15(16)17(23-24-18)20-11-6-12-21-19(26)22-13-14-7-2-1-3-8-14/h1-5,7-10H,6,11-13H2,(H,20,23)(H,24,25)(H2,21,22,26)