2-[2-methyl-4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[2-methyl-4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide Openeye Name: 2-[4-[(isopentylamino)methyl]-2-methyl-phenoxy]thiazole-5-carboxamide CAS Name: 2-[2-methyl-4-[(3-methylbutylamino)methyl]phenoxy]-5-thiazolecarboxamide IUPAC Name: 2-[2-methyl-4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide Traditional Name: 2-[4-[(isoamylamino)methyl]-2-methyl-phenoxy]thiazole-5-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNCCC(C)C)OC2=NC=C(S2)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)CNCCC(C)C)OC2=NC=C(S2)C(=O)N

InChI

InChI=1S/C17H23N3O2S/c1-11(2)6-7-19-9-13-4-5-14(12(3)8-13)22-17-20-10-15(23-17)16(18)21/h4-5,8,10-11,19H,6-7,9H2,1-3H3,(H2,18,21)