5-[(4-butylphenyl)methyl]-2-[(3-methylpyridin-2-yl)amino]-1,3-thiazol-4-one

Systemtic Name: 5-[(4-butylphenyl)methyl]-2-[(3-methylpyridin-2-yl)amino]-1,3-thiazol-4-one Openeye Name: 5-[(4-butylphenyl)methyl]-2-[(3-methyl-2-pyridyl)amino]thiazol-4-one CAS Name: 5-[(4-butylphenyl)methyl]-2-[(3-methyl-2-pyridinyl)amino]-4-thiazolone IUPAC Name: 5-[(4-butylphenyl)methyl]-2-[(3-methylpyridin-2-yl)amino]-1,3-thiazol-4-one Traditional Name: 5-(4-butylbenzyl)-2-[(3-methyl-2-pyridyl)amino]-2-thiazolin-4-one Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC2C(=O)N=C(S2)NC3=C(C=CC=N3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC2C(=O)N=C(S2)NC3=C(C=CC=N3)C

InChI

InChI=1S/C20H23N3OS/c1-3-4-7-15-8-10-16(11-9-15)13-17-19(24)23-20(25-17)22-18-14(2)6-5-12-21-18/h5-6,8-12,17H,3-4,7,13H2,1-2H3,(H,21,22,23,24)