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

Systemtic Name: 2-[4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide Openeye Name: 2-[4-[(isopentylamino)methyl]phenoxy]thiazole-5-carboxamide CAS Name: 2-[4-[(3-methylbutylamino)methyl]phenoxy]-5-thiazolecarboxamide IUPAC Name: 2-[4-[(3-methylbutylamino)methyl]phenoxy]-1,3-thiazole-5-carboxamide Traditional Name: 2-[4-[(isoamylamino)methyl]phenoxy]thiazole-5-carboxamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O2S/c1-11(2)7-8-18-9-12-3-5-13(6-4-12)21-16-19-10-14(22-16)15(17)20/h3-6,10-11,18H,7-9H2,1-2H3,(H2,17,20)