[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-morpholin-4-yl-methanethione

Systemtic Name: [1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-morpholin-4-yl-methanethione Openeye Name: [1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-morpholino-methanethione CAS Name: [1-(4-bromo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]-(4-morpholinyl)methanethione IUPAC Name: [1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]-morpholin-4-ylmethanethione Traditional Name: [1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-morpholino-methanethione Formula: C18H21BrN2OS MolecularWeight: 393.34114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)C(=S)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)C(=S)N3CCOCC3

InChI

InChI=1S/C18H21BrN2OS/c1-12-10-15(4-5-17(12)19)21-13(2)11-16(14(21)3)18(23)20-6-8-22-9-7-20/h4-5,10-11H,6-9H2,1-3H3