1-(3-chloranyl-4-methyl-phenyl)-3-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]thiourea Formula: C18H16ClN5O2S MolecularWeight: 401.86994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN5O2S/c1-10-7-8-11(9-14(10)19)20-18(27)22-21-16(25)15-12-5-3-4-6-13(12)17(26)24(2)23-15/h3-9H,1-2H3,(H,21,25)(H2,20,22,27)