5-azanyl-4-(1,3-benzothiazol-2-yl)-1-(4-butoxyphenyl)-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(1,3-benzothiazol-2-yl)-1-(4-butoxyphenyl)-2H-pyrrol-3-one Openeye Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(4-butoxyphenyl)-2H-pyrrol-3-one CAS Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(4-butoxyphenyl)-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(4-butoxyphenyl)-2H-pyrrol-3-one Traditional Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(4-butoxyphenyl)-2-pyrrolin-3-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2CC(=O)C(=C2N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2CC(=O)C(=C2N)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3O2S/c1-2-3-12-26-15-10-8-14(9-11-15)24-13-17(25)19(20(24)22)21-23-16-6-4-5-7-18(16)27-21/h4-11H,2-3,12-13,22H2,1H3