5-azanyl-4-(1,3-benzothiazol-2-yl)-1-(2-bromanyl-4-methyl-phenyl)-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(1,3-benzothiazol-2-yl)-1-(2-bromanyl-4-methyl-phenyl)-2H-pyrrol-3-one Openeye Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-bromo-4-methyl-phenyl)-2H-pyrrol-3-one CAS Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-bromo-4-methylphenyl)-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-bromo-4-methylphenyl)-2H-pyrrol-3-one Traditional Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-bromo-4-methyl-phenyl)-2-pyrrolin-3-one Formula: C18H14BrN3OS MolecularWeight: 400.29226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CC(=O)C(=C2N)C3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2CC(=O)C(=C2N)C3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C18H14BrN3OS/c1-10-6-7-13(11(19)8-10)22-9-14(23)16(17(22)20)18-21-12-4-2-3-5-15(12)24-18/h2-8H,9,20H2,1H3