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

Systemtic Name: 2-[2-methoxy-4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide Openeye Name: 2-[4-[(isopentylamino)methyl]-2-methoxy-phenoxy]thiazole-5-carboxamide CAS Name: 2-[2-methoxy-4-[(3-methylbutylamino)methyl]phenoxy]-5-thiazolecarboxamide IUPAC Name: 2-[2-methoxy-4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide Traditional Name: 2-[4-[(isoamylamino)methyl]-2-methoxy-phenoxy]thiazole-5-carboxamide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC1=CC(=C(C=C1)OC2=NC=C(S2)C(=O)N)OC

Isomeric SMILES

CC(C)CCNCC1=CC(=C(C=C1)OC2=NC=C(S2)C(=O)N)OC

InChI

InChI=1S/C17H23N3O3S/c1-11(2)6-7-19-9-12-4-5-13(14(8-12)22-3)23-17-20-10-15(24-17)16(18)21/h4-5,8,10-11,19H,6-7,9H2,1-3H3,(H2,18,21)