5-azanyl-6-(4-propan-2-ylphenyl)sulfanyl-2,3-dihydroinden-1-one

Systemtic Name: 5-azanyl-6-(4-propan-2-ylphenyl)sulfanyl-2,3-dihydroinden-1-one Openeye Name: 5-amino-6-(4-isopropylphenyl)sulfanyl-indan-1-one CAS Name: 5-amino-6-[(4-propan-2-ylphenyl)thio]-2,3-dihydroinden-1-one IUPAC Name: 5-amino-6-(4-propan-2-ylphenyl)sulfanyl-2,3-dihydroinden-1-one Traditional Name: 5-amino-6-(p-cumenylthio)indan-1-one Formula: C18H19NOS MolecularWeight: 297.41456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SC2=C(C=C3CCC(=O)C3=C2)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC2=C(C=C3CCC(=O)C3=C2)N

InChI

InChI=1S/C18H19NOS/c1-11(2)12-3-6-14(7-4-12)21-18-10-15-13(9-16(18)19)5-8-17(15)20/h3-4,6-7,9-11H,5,8,19H2,1-2H3