1-[2-[4-(3,4-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]thiourea

Systemtic Name: 1-[2-[4-(3,4-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]thiourea Openeye Name: [[2-[4-(3,4-dimethylphenyl)-1-oxo-phthalazin-2-yl]acetyl]amino]thiourea CAS Name: [[2-[4-(3,4-dimethylphenyl)-1-oxo-2-phthalazinyl]-1-oxoethyl]amino]thiourea IUPAC Name: [[2-[4-(3,4-dimethylphenyl)-1-oxophthalazin-2-yl]acetyl]amino]thiourea Traditional Name: [[2-[4-(3,4-dimethylphenyl)-1-keto-phthalazin-2-yl]acetyl]amino]thiourea Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)NNC(=S)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)NNC(=S)N)C

InChI

InChI=1S/C19H19N5O2S/c1-11-7-8-13(9-12(11)2)17-14-5-3-4-6-15(14)18(26)24(23-17)10-16(25)21-22-19(20)27/h3-9H,10H2,1-2H3,(H,21,25)(H3,20,22,27)