1-phenyl-3-[[(4-phenylphthalazin-1-yl)amino]carbamothioyl]thiourea

Systemtic Name: 1-phenyl-3-[[(4-phenylphthalazin-1-yl)amino]carbamothioyl]thiourea Openeye Name: 1-phenyl-3-[[(4-phenylphthalazin-1-yl)amino]carbamothioyl]thiourea CAS Name: 1-[anilino(sulfanylidene)methyl]-3-[(4-phenyl-1-phthalazinyl)amino]thiourea IUPAC Name: 1-phenyl-3-[[(4-phenylphthalazin-1-yl)amino]carbamothioyl]thiourea Traditional Name: 1-phenyl-3-[[(4-phenylphthalazin-1-yl)amino]thiocarbamoyl]thiourea Formula: C22H18N6S2 MolecularWeight: 430.54852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NNC(=S)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NNC(=S)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C22H18N6S2/c29-21(23-16-11-5-2-6-12-16)24-22(30)28-27-20-18-14-8-7-13-17(18)19(25-26-20)15-9-3-1-4-10-15/h1-14H,(H,26,27)(H3,23,24,28,29,30)