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

Systemtic Name: 1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-(4-sulfamoylphenyl)thiourea Formula: C18H20N6O3S2 MolecularWeight: 432.5198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H20N6O3S2/c19-29(26,27)13-8-6-12(7-9-13)22-18(28)21-11-3-10-20-16-14-4-1-2-5-15(14)17(25)24-23-16/h1-2,4-9H,3,10-11H2,(H,20,23)(H,24,25)(H2,19,26,27)(H2,21,22,28)