4-[[3-(3-imidazol-1-ylpropyl)-4-(2-methoxyphenyl)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[3-(3-imidazol-1-ylpropyl)-4-(2-methoxyphenyl)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[3-(3-imidazol-1-ylpropyl)-4-(2-methoxyphenyl)thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[3-[3-(1-imidazolyl)propyl]-4-(2-methoxyphenyl)-2-thiazolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[3-(3-imidazol-1-ylpropyl)-4-(2-methoxyphenyl)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[3-(3-imidazol-1-ylpropyl)-4-(2-methoxyphenyl)-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C27H28N6O2S MolecularWeight: 500.61522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC=CC=C4OC)CCCN5C=CN=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC=CC=C4OC)CCCN5C=CN=C5

InChI

InChI=1S/C27H28N6O2S/c1-20-25(26(34)33(30(20)2)21-10-5-4-6-11-21)29-27-32(16-9-15-31-17-14-28-19-31)23(18-36-27)22-12-7-8-13-24(22)35-3/h4-8,10-14,17-19H,9,15-16H2,1-3H3