4-(4-chloranyl-2-methyl-phenoxy)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(2-phenylthiazol-4-yl)methyl]butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[(2-phenyl-4-thiazolyl)methyl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(2-phenylthiazol-4-yl)methyl]butyramide Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClN2O2S/c1-15-12-17(22)9-10-19(15)26-11-5-8-20(25)23-13-18-14-27-21(24-18)16-6-3-2-4-7-16/h2-4,6-7,9-10,12,14H,5,8,11,13H2,1H3,(H,23,25)