N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide Formula: C24H23N5O3S2 MolecularWeight: 493.60112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)CC4=CC=CC=C4)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)CC4=CC=CC=C4)SCC(=O)N

InChI

InChI=1S/C24H23N5O3S2/c1-15-23(33-14-20(25)30)34-24(26-15)27-22(31)19-13-29(12-16-7-4-3-5-8-16)28-21(19)17-9-6-10-18(11-17)32-2/h3-11,13H,12,14H2,1-2H3,(H2,25,30)(H,26,27,31)