1-[(E)-1-[4-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)amino]phenyl]ethylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-1-[4-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)amino]phenyl]ethylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-1-[4-[(4-oxo-3-phenyl-phthalazin-1-yl)amino]phenyl]ethylideneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-1-[4-[(4-oxo-3-phenyl-1-phthalazinyl)amino]phenyl]ethylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-1-[4-[(4-oxo-3-phenylphthalazin-1-yl)amino]phenyl]ethylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-1-[4-[(4-keto-3-phenyl-phthalazin-1-yl)amino]phenyl]ethylideneamino]-3-phenyl-thiourea Formula: C29H24N6OS MolecularWeight: 504.60546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=CC=C1)C2=CC=C(C=C2)NC3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C/C(=N\NC(=S)NC1=CC=CC=C1)/C2=CC=C(C=C2)NC3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C29H24N6OS/c1-20(32-33-29(37)31-22-10-4-2-5-11-22)21-16-18-23(19-17-21)30-27-25-14-8-9-15-26(25)28(36)35(34-27)24-12-6-3-7-13-24/h2-19H,1H3,(H,30,34)(H2,31,33,37)/b32-20+