N-[2-[2-adamantylidene-(3-hydroxyphenyl)methoxy]ethyl]-6-oxidanyl-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[2-[2-adamantylidene-(3-hydroxyphenyl)methoxy]ethyl]-6-oxidanyl-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-[2-adamantylidene-(3-hydroxyphenyl)methoxy]ethyl]-6-hydroxy-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-[2-adamantylidene-(3-hydroxyphenyl)methoxy]ethyl]-6-hydroxy-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-[2-adamantylidene-(3-hydroxyphenyl)methoxy]ethyl]-6-hydroxy-1,3-benzothiazole-2-carboxamide Traditional Name: N-[2-[2-adamantylidene-(3-hydroxyphenyl)methoxy]ethyl]-6-hydroxy-1,3-benzothiazole-2-carboxamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3=C(C4=CC(=CC=C4)O)OCCNC(=O)C5=NC6=C(S5)C=C(C=C6)O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3=C(C4=CC(=CC=C4)O)OCCNC(=O)C5=NC6=C(S5)C=C(C=C6)O

InChI

InChI=1S/C27H28N2O4S/c30-20-3-1-2-17(13-20)25(24-18-9-15-8-16(11-18)12-19(24)10-15)33-7-6-28-26(32)27-29-22-5-4-21(31)14-23(22)34-27/h1-5,13-16,18-19,30-31H,6-12H2,(H,28,32)