4-oxidanyl-7-[1-oxidanyl-2-[2-(4-pyrrolidin-1-ylphenyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 4-oxidanyl-7-[1-oxidanyl-2-[2-(4-pyrrolidin-1-ylphenyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 4-hydroxy-7-[1-hydroxy-2-[2-(4-pyrrolidin-1-ylphenyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[1-hydroxy-2-[2-[4-(1-pyrrolidinyl)phenyl]ethylamino]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[1-hydroxy-2-[2-(4-pyrrolidin-1-ylphenyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 4-hydroxy-7-[1-hydroxy-2-[2-(4-pyrrolidinophenyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)CCNCC(C3=C4C(=C(C=C3)O)NC(=O)S4)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)CCNCC(C3=C4C(=C(C=C3)O)NC(=O)S4)O

InChI

InChI=1S/C21H25N3O3S/c25-17-8-7-16(20-19(17)23-21(27)28-20)18(26)13-22-10-9-14-3-5-15(6-4-14)24-11-1-2-12-24/h3-8,18,22,25-26H,1-2,9-13H2,(H,23,27)