5-azanyl-3-(1-phenylpropan-2-ylamino)-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-(1-phenylpropan-2-ylamino)-1,2-thiazole-4-carbonitrile Openeye Name: 5-amino-3-[(1-methyl-2-phenyl-ethyl)amino]isothiazole-4-carbonitrile CAS Name: 5-amino-3-(1-phenylpropan-2-ylamino)-4-isothiazolecarbonitrile IUPAC Name: 5-amino-3-(1-phenylpropan-2-ylamino)-1,2-thiazole-4-carbonitrile Traditional Name: 5-amino-3-[(1-methyl-2-phenyl-ethyl)amino]isothiazole-4-carbonitrile Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NC2=NSC(=C2C#N)N

Isomeric SMILES

CC(CC1=CC=CC=C1)NC2=NSC(=C2C#N)N

InChI

InChI=1S/C13H14N4S/c1-9(7-10-5-3-2-4-6-10)16-13-11(8-14)12(15)18-17-13/h2-6,9H,7,15H2,1H3,(H,16,17)