N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[2-[5-(2-methylthiazol-4-yl)-2-thienyl]ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-[5-(2-methyl-4-thiazolyl)-2-thiophenyl]ethyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[2-[5-(2-methylthiazol-4-yl)-2-thienyl]ethyl]phthalazine-1-carboxamide Formula: C26H22N4O2S2 MolecularWeight: 486.60848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(S2)CCNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(S2)CCNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H22N4O2S2/c1-17-28-22(16-33-17)23-12-11-19(34-23)13-14-27-25(31)24-20-9-5-6-10-21(20)26(32)30(29-24)15-18-7-3-2-4-8-18/h2-12,16H,13-15H2,1H3,(H,27,31)