1-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-2-(3-isopentyloxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-hydroxy-5-(3-isoamoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C27H23ClN2O4S2 MolecularWeight: 539.06552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)Cl)O)C(=O)C5=CC=CS5

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)Cl)O)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H23ClN2O4S2/c1-15(2)10-11-34-18-6-3-5-16(13-18)23-22(24(31)20-7-4-12-35-20)25(32)26(33)30(23)27-29-19-9-8-17(28)14-21(19)36-27/h3-9,12-15,23,32H,10-11H2,1-2H3