1-(2,4-dichlorophenyl)-3-[4-oxidanylidene-1-(thiophen-3-ylmethyl)-3H-phthalazin-6-yl]urea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[4-oxidanylidene-1-(thiophen-3-ylmethyl)-3H-phthalazin-6-yl]urea Openeye Name: 1-(2,4-dichlorophenyl)-3-[4-oxo-1-(3-thienylmethyl)-3H-phthalazin-6-yl]urea CAS Name: 1-(2,4-dichlorophenyl)-3-[4-oxo-1-(3-thiophenylmethyl)-3H-phthalazin-6-yl]urea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[4-oxo-1-(thiophen-3-ylmethyl)-3H-phthalazin-6-yl]urea Traditional Name: 1-(2,4-dichlorophenyl)-3-[4-keto-1-(3-thenyl)-3H-phthalazin-6-yl]urea Formula: C20H14Cl2N4O2S MolecularWeight: 445.32176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)NC3=C(C=C(C=C3)Cl)Cl)C(=O)NN=C2CC4=CSC=C4

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)NC3=C(C=C(C=C3)Cl)Cl)C(=O)NN=C2CC4=CSC=C4

InChI

InChI=1S/C20H14Cl2N4O2S/c21-12-1-4-17(16(22)8-12)24-20(28)23-13-2-3-14-15(9-13)19(27)26-25-18(14)7-11-5-6-29-10-11/h1-6,8-10H,7H2,(H,26,27)(H2,23,24,28)