N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-thiazolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]-3-methyl-phthalazine-1-carboxamide Formula: C26H23N5O3S MolecularWeight: 485.55752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C3=CSC(=N3)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C3=CSC(=N3)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)C

InChI

InChI=1S/C26H23N5O3S/c1-15-13-21(16(2)31(15)17-9-11-18(34-4)12-10-17)22-14-35-26(27-22)28-24(32)23-19-7-5-6-8-20(19)25(33)30(3)29-23/h5-14H,1-4H3,(H,27,28,32)