3-(5-chloranyl-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)-1,2-oxazole

Systemtic Name: 3-(5-chloranyl-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)-1,2-oxazole Openeye Name: 3-(5-chloro-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)isoxazole CAS Name: 3-[5-chloro-4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinyl]isoxazole IUPAC Name: 3-(5-chloro-4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)-1,2-oxazole Traditional Name: 3-(5-chloro-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)isoxazole Formula: C16H12ClN3OS MolecularWeight: 329.80398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(SC2=NC(=C1Cl)C)C3=NOC=C3)N4C=CC=C4

Isomeric SMILES

CC1=C2C(=C(SC2=NC(=C1Cl)C)C3=NOC=C3)N4C=CC=C4

InChI

InChI=1S/C16H12ClN3OS/c1-9-12-14(20-6-3-4-7-20)15(11-5-8-21-19-11)22-16(12)18-10(2)13(9)17/h3-8H,1-2H3