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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)CC(=C2N)C3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)CC(=C2N)C3=NC4=CC=CC=C4S3)Br

InChI

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