5-(butylamino)-2-(4-morpholin-4-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(butylamino)-2-(4-morpholin-4-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(butylamino)-2-(4-morpholinosulfonylphenyl)oxazole-4-carbonitrile CAS Name: 5-(butylamino)-2-[4-(4-morpholinylsulfonyl)phenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(butylamino)-2-(4-morpholin-4-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(butylamino)-2-(4-morpholinosulfonylphenyl)oxazole-4-carbonitrile Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(N=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C#N

Isomeric SMILES

CCCCNC1=C(N=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C#N

InChI

InChI=1S/C18H22N4O4S/c1-2-3-8-20-18-16(13-19)21-17(26-18)14-4-6-15(7-5-14)27(23,24)22-9-11-25-12-10-22/h4-7,20H,2-3,8-12H2,1H3