N-[1-[2-[(2-methyl-1,3-thiazol-4-yl)methylamino]-2-oxidanylidene-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide

Systemtic Name: N-[1-[2-[(2-methyl-1,3-thiazol-4-yl)methylamino]-2-oxidanylidene-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide Openeye Name: N-[1-[2-[(2-methylthiazol-4-yl)methylamino]-2-oxo-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide CAS Name: N-[1-[2-[(2-methyl-4-thiazolyl)methylamino]-2-oxoethyl]-4-pyrazolyl]-3-phenoxypropanamide IUPAC Name: N-[1-[2-[(2-methyl-1,3-thiazol-4-yl)methylamino]-2-oxoethyl]pyrazol-4-yl]-3-phenoxypropanamide Traditional Name: N-[1-[2-keto-2-[(2-methylthiazol-4-yl)methylamino]ethyl]pyrazol-4-yl]-3-phenoxy-propionamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CNC(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CS1)CNC(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3

InChI

InChI=1S/C19H21N5O3S/c1-14-22-16(13-28-14)9-20-19(26)12-24-11-15(10-21-24)23-18(25)7-8-27-17-5-3-2-4-6-17/h2-6,10-11,13H,7-9,12H2,1H3,(H,20,26)(H,23,25)