5-azanyl-4-(1,3-benzothiazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(1,3-benzothiazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-pyrrol-3-one Openeye Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-pyrrol-3-one CAS Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-pyrrol-3-one Traditional Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-homoveratryl-2-pyrrolin-3-one Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(=O)C(=C2N)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC(=O)C(=C2N)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C21H21N3O3S/c1-26-16-8-7-13(11-17(16)27-2)9-10-24-12-15(25)19(20(24)22)21-23-14-5-3-4-6-18(14)28-21/h3-8,11H,9-10,12,22H2,1-2H3