N-(heptan-4-ylideneamino)-2-[(4-nitrophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(heptan-4-ylideneamino)-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-(1-propylbutylideneamino)acetamide CAS Name: N-(heptan-4-ylideneamino)-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-(heptan-4-ylideneamino)-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: 2-[(4-nitrobenzyl)thio]-N-(1-propylbutylideneamino)acetamide Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)CSCC1=CC=C(C=C1)[N+](=O)[O-])CCC

Isomeric SMILES

CCCC(=NNC(=O)CSCC1=CC=C(C=C1)[N+](=O)[O-])CCC

InChI

InChI=1S/C16H23N3O3S/c1-3-5-14(6-4-2)17-18-16(20)12-23-11-13-7-9-15(10-8-13)19(21)22/h7-10H,3-6,11-12H2,1-2H3,(H,18,20)