N-butylbut-3-enamide; 3-(5-thiabicyclo[2.1.0]penta-1(4),2-dien-3-yl)pyridine

Systemtic Name: N-butylbut-3-enamide; 3-(5-thiabicyclo[2.1.0]penta-1(4),2-dien-3-yl)pyridine Openeye Name: N-butylbut-3-enamide; 3-(5-thiabicyclo[2.1.0]penta-1(4),2-dien-3-yl)pyridine CAS Name: N-butyl-3-butenamide; 3-(5-thiabicyclo[2.1.0]penta-1(4),2-dien-3-yl)pyridine IUPAC Name: N-butylbut-3-enamide; 3-(5-thiabicyclo[2.1.0]penta-1(4),2-dien-3-yl)pyridine Traditional Name: N-butylbut-3-enamide; 3-(5-thiabicyclo[2.1.0]penta-1(4),2-dien-3-yl)pyridine Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC=C.C1=CC(=CN=C1)C2=CC3=C2S3

Isomeric SMILES

CCCCNC(=O)CC=C.C1=CC(=CN=C1)C2=CC3=C2S3

InChI

InChI=1S/C9H5NS.C8H15NO/c1-2-6(5-10-3-1)7-4-8-9(7)11-8;1-3-5-7-9-8(10)6-4-2/h1-5H;4H,2-3,5-7H2,1H3,(H,9,10)