(5-methylsulfanyl-3-propan-2-yl-1H-pyrrol-2-yl)-phenyl-methanone

Systemtic Name: (5-methylsulfanyl-3-propan-2-yl-1H-pyrrol-2-yl)-phenyl-methanone Openeye Name: (3-isopropyl-5-methylsulfanyl-1H-pyrrol-2-yl)-phenyl-methanone CAS Name: [5-(methylthio)-3-propan-2-yl-1H-pyrrol-2-yl]-phenylmethanone IUPAC Name: (5-methylsulfanyl-3-propan-2-yl-1H-pyrrol-2-yl)-phenylmethanone Traditional Name: [3-isopropyl-5-(methylthio)-1H-pyrrol-2-yl]-phenyl-methanone Formula: C15H17NOS MolecularWeight: 259.36658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=C1)SC)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=C(NC(=C1)SC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17NOS/c1-10(2)12-9-13(18-3)16-14(12)15(17)11-7-5-4-6-8-11/h4-10,16H,1-3H3