(4E)-6-(aminomethyl)-4-(1-sulfanylbutylidene)-2,3-dihydro-1H-inden-5-one

Systemtic Name: (4E)-6-(aminomethyl)-4-(1-sulfanylbutylidene)-2,3-dihydro-1H-inden-5-one Openeye Name: (4E)-6-(aminomethyl)-4-(1-sulfanylbutylidene)-2,3-dihydro-1H-inden-5-one CAS Name: (4E)-6-(aminomethyl)-4-(1-mercaptobutylidene)-2,3-dihydro-1H-inden-5-one IUPAC Name: (4E)-6-(aminomethyl)-4-(1-sulfanylbutylidene)-2,3-dihydro-1H-inden-5-one Traditional Name: (4E)-6-(aminomethyl)-4-(1-mercaptobutylidene)-2,3-dihydro-1H-inden-5-one Formula: C14H19NOS MolecularWeight: 249.37176

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C2=C(CCC2)C=C(C1=O)CN)S

Isomeric SMILES

CCC/C(=C\1/C2=C(CCC2)C=C(C1=O)CN)/S

InChI

InChI=1S/C14H19NOS/c1-2-4-12(17)13-11-6-3-5-9(11)7-10(8-15)14(13)16/h7,17H,2-6,8,15H2,1H3/b13-12+