5-(butan-2-ylamino)-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(butan-2-ylamino)-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[4-(1-piperidylsulfonyl)phenyl]-5-(sec-butylamino)oxazole-4-carbonitrile CAS Name: 5-(butan-2-ylamino)-2-[4-(1-piperidinylsulfonyl)phenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(butan-2-ylamino)-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-piperidinosulfonylphenyl)-5-(sec-butylamino)oxazole-4-carbonitrile Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(N=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C#N

Isomeric SMILES

CCC(C)NC1=C(N=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C#N

InChI

InChI=1S/C19H24N4O3S/c1-3-14(2)21-19-17(13-20)22-18(26-19)15-7-9-16(10-8-15)27(24,25)23-11-5-4-6-12-23/h7-10,14,21H,3-6,11-12H2,1-2H3