1-(3-chloranyl-2-methyl-phenyl)-3-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]thiourea Formula: C19H18ClN5O2S MolecularWeight: 415.89652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C19H18ClN5O2S/c1-3-25-18(27)13-8-5-4-7-12(13)16(24-25)17(26)22-23-19(28)21-15-10-6-9-14(20)11(15)2/h4-10H,3H2,1-2H3,(H,22,26)(H2,21,23,28)