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

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-methoxy-4-(3-methylbutoxy)phenyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-(4-isopentyloxy-3-methoxy-phenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-[3-methoxy-4-(3-methylbutoxy)phenyl]-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-[3-methoxy-4-(3-methylbutoxy)phenyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-(4-isoamoxy-3-methoxy-phenyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C30H30N2O5S2 MolecularWeight: 562.6996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC(=C(C=C5)OCCC(C)C)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC(=C(C=C5)OCCC(C)C)OC)C

InChI

InChI=1S/C30H30N2O5S2/c1-16(2)10-11-37-20-9-8-19(15-21(20)36-5)26-24(27(33)22-7-6-12-38-22)28(34)29(35)32(26)30-31-25-18(4)13-17(3)14-23(25)39-30/h6-9,12-16,26,34H,10-11H2,1-5H3