2-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(4-butylanilino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(4-butylanilino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(4-butylanilino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-(4-butylanilino)-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=NOC(=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=NOC(=C2)C

InChI

InChI=1S/C19H25N3O3S/c1-4-5-6-15-7-9-16(10-8-15)20-18(23)12-26-14(3)19(24)21-17-11-13(2)25-22-17/h7-11,14H,4-6,12H2,1-3H3,(H,20,23)(H,21,22,24)