N-(3-ethylphenyl)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(3-ethylphenyl)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-ethylphenyl)-4-[(5-methylisoxazol-3-yl)methyl]piperazine-1-carbothioamide CAS Name: N-(3-ethylphenyl)-4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-ethylphenyl)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3-ethylphenyl)-4-[(5-methylisoxazol-3-yl)methyl]piperazine-1-carbothioamide Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N2CCN(CC2)CC3=NOC(=C3)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N2CCN(CC2)CC3=NOC(=C3)C

InChI

InChI=1S/C18H24N4OS/c1-3-15-5-4-6-16(12-15)19-18(24)22-9-7-21(8-10-22)13-17-11-14(2)23-20-17/h4-6,11-12H,3,7-10,13H2,1-2H3,(H,19,24)