N-[2-chloranyl-9-[2,6-di(propan-2-yl)phenyl]thioxanthen-9-yl]ethanamide

Systemtic Name: N-[2-chloranyl-9-[2,6-di(propan-2-yl)phenyl]thioxanthen-9-yl]ethanamide Openeye Name: N-[2-chloro-9-(2,6-diisopropylphenyl)thioxanthen-9-yl]acetamide CAS Name: N-[2-chloro-9-[2,6-di(propan-2-yl)phenyl]-9-thioxanthenyl]acetamide IUPAC Name: N-[2-chloro-9-[2,6-di(propan-2-yl)phenyl]thioxanthen-9-yl]acetamide Traditional Name: N-[2-chloro-9-(2,6-diisopropylphenyl)thioxanthen-9-yl]acetamide Formula: C27H28ClNOS MolecularWeight: 450.03532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)C2(C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)NC(=O)C

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)C2(C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)NC(=O)C

InChI

InChI=1S/C27H28ClNOS/c1-16(2)20-9-8-10-21(17(3)4)26(20)27(29-18(5)30)22-11-6-7-12-24(22)31-25-14-13-19(28)15-23(25)27/h6-17H,1-5H3,(H,29,30)